
 PYY13-36, porcine

422427  0  0  0  0  0  0  0  0999 V2000
   -1.2003   -3.4489  -22.2643 C   0  0  0  0  0
   -2.1873   -3.9647  -23.3178 C   0  0  0  0  0
   -1.7345   -3.4980  -24.7010 C   0  0  0  0  0
   -2.2950   -5.5024  -23.2087 C   0  0  0  0  0
   -3.5163   -6.1242  -23.9037 C   0  0  0  0  0
   -3.4297   -6.2230  -25.4390 C   0  0  0  0  0
   -4.1764   -5.5011  -26.1170 O   0  0  0  0  0
   -2.5788   -6.9923  -26.1528 N   0  0  0  0  0
   -1.6183   -8.0753  -25.9010 C   0  0  0  0  0
   -0.4494   -7.7854  -24.9623 C   0  0  0  0  0
    0.6524   -8.6380  -25.2955 O   0  0  0  0  0
   -2.2901   -9.4064  -25.5266 C   0  0  0  0  0
   -3.4232   -9.4696  -25.0594 O   0  0  0  0  0
   -1.4938  -10.5083  -25.7365 N   0  0  0  0  0
   -1.8911  -11.8465  -25.3055 C   0  0  0  0  0
   -1.4237  -12.8505  -26.3686 C   0  0  0  0  0
   -2.0599  -14.2312  -26.2299 C   0  0  0  0  0
   -1.5795  -15.1802  -27.3272 C   0  0  0  0  0
   -2.1791  -16.4899  -27.1637 N   0  0  0  0  0
   -3.4279  -16.8237  -27.5531 C   0  0  0  0  0
   -4.2307  -16.1836  -28.3178 N   0  0  0  0  0
   -3.8024  -18.0134  -27.0483 N   0  0  0  0  0
   -1.2020  -12.1044  -23.9446 C   0  0  0  0  0
   -0.0815  -11.6632  -23.6873 O   0  0  0  0  0
   -1.9132  -12.8953  -23.0714 N   0  0  0  0  0
   -1.2953  -13.5011  -21.8767 C   0  0  0  0  0
   -1.9860  -13.0466  -20.5811 C   0  0  0  0  0
   -3.2156  -13.7733  -20.0785 C   0  0  0  0  0
   -3.3668  -13.9597  -18.6915 C   0  0  0  0  0
   -4.4904  -14.5976  -18.1658 C   0  0  0  0  0
   -5.4894  -15.0350  -19.0207 C   0  0  0  0  0
   -5.3820  -14.8392  -20.3924 C   0  0  0  0  0
   -4.2518  -14.2010  -20.9166 C   0  0  0  0  0
   -6.5728  -15.6518  -18.4704 O   0  0  0  0  0
   -1.2720  -15.0168  -22.1404 C   0  0  0  0  0
   -2.0049  -15.5074  -23.0104 O   0  0  0  0  0
   -0.4610  -15.8782  -21.4841 N   0  0  0  0  0
    0.4233  -15.7607  -20.3249 C   0  0  0  0  0
    1.4594  -14.6246  -20.4007 C   0  0  0  0  0
    2.7644  -15.0491  -19.7512 C   0  0  0  0  0
    3.7384  -15.7214  -20.5057 C   0  0  0  0  0
    4.8989  -16.1997  -19.8964 C   0  0  0  0  0
    5.0885  -16.0105  -18.5336 C   0  0  0  0  0
    4.1404  -15.3391  -17.7690 C   0  0  0  0  0
    2.9792  -14.8580  -18.3790 C   0  0  0  0  0
    6.2280  -16.5100  -17.9764 O   0  0  0  0  0
   -0.3570  -15.8094  -18.9895 C   0  0  0  0  0
   -0.3121  -14.8745  -18.1837 O   0  0  0  0  0
   -1.0322  -16.9298  -18.5889 N   0  0  0  0  0
   -1.4576  -18.1436  -19.3034 C   0  0  0  0  0
   -2.7410  -17.9221  -20.0944 C   0  0  0  0  0
   -0.3282  -18.7657  -20.1363 C   0  0  0  0  0
   -0.3575  -18.7472  -21.3721 O   0  0  0  0  0
    0.8238  -19.2091  -19.5565 N   0  0  0  0  0
    1.0946  -19.7508  -18.2157 C   0  0  0  0  0
    0.5986  -18.9829  -16.9867 C   0  0  0  0  0
    1.2181  -19.4277  -15.7774 O   0  0  0  0  0
    0.5842  -21.1968  -18.2173 C   0  0  0  0  0
   -0.6140  -21.4470  -18.3838 O   0  0  0  0  0
    1.4429  -22.2538  -18.1328 N   0  0  0  0  0
    2.9050  -22.3276  -17.9633 C   0  0  0  0  0
    3.6932  -21.6702  -19.1138 C   0  0  0  0  0
    5.1055  -22.2684  -19.3035 C   0  0  0  0  0
    5.0605  -23.6373  -19.9880 C   0  0  0  0  0
    5.9711  -21.3182  -20.1367 C   0  0  0  0  0
    3.2468  -21.7667  -16.5672 C   0  0  0  0  0
    3.5488  -20.5783  -16.4029 O   0  0  0  0  0
    3.0608  -22.5086  -15.4347 N   0  0  0  0  0
    3.1780  -23.9613  -15.2410 C   0  0  0  0  0
    2.1197  -24.8086  -15.9584 C   0  0  0  0  0
    1.9568  -26.1779  -15.2839 C   0  0  0  0  0
    0.8741  -27.0150  -15.9649 C   0  0  0  0  0
    0.7352  -28.2948  -15.2985 N   0  0  0  0  0
   -0.0172  -28.5137  -14.1980 C   0  0  0  0  0
   -0.5826  -27.6648  -13.4257 N   0  0  0  0  0
   -0.1333  -29.8284  -13.9333 N   0  0  0  0  0
    4.6304  -24.2915  -15.6132 C   0  0  0  0  0
    4.9302  -24.6749  -16.7471 O   0  0  0  0  0
    5.6625  -23.9701  -14.7751 N   0  0  0  0  0
    5.7359  -24.1008  -13.3074 C   0  0  0  0  0
    4.9024  -23.1112  -12.4775 C   0  0  0  0  0
    5.1485  -23.2644  -11.0119 C   0  0  0  0  0
    6.0853  -22.7218  -10.1594 C   0  0  0  0  0
    5.9183  -23.1976   -8.8839 N   0  0  0  0  0
    4.8992  -24.0220   -8.9490 C   0  0  0  0  0
    4.3979  -24.0990  -10.2160 N   0  0  0  0  0
    5.4176  -25.5686  -12.9891 C   0  0  0  0  0
    4.2566  -25.9240  -12.7564 O   0  0  0  0  0
    6.3600  -26.5443  -13.1073 N   0  0  0  0  0
    7.8358  -26.4822  -13.1182 C   0  0  0  0  0
    8.4556  -25.6980  -14.2843 C   0  0  0  0  0
    9.9038  -26.0587  -14.5336 C   0  0  0  0  0
   10.2322  -27.1204  -15.3888 C   0  0  0  0  0
   11.5671  -27.4538  -15.6255 C   0  0  0  0  0
   12.5743  -26.7254  -15.0038 C   0  0  0  0  0
   12.2688  -25.6799  -14.1411 C   0  0  0  0  0
   10.9348  -25.3460  -13.9046 C   0  0  0  0  0
   13.8893  -27.0072  -15.2229 O   0  0  0  0  0
    8.2878  -25.9663  -11.7411 C   0  0  0  0  0
    8.4557  -24.7595  -11.5396 O   0  0  0  0  0
    8.3831  -26.7965  -10.6619 N   0  0  0  0  0
    8.5582  -28.2577  -10.5945 C   0  0  0  0  0
    7.3475  -29.0643  -11.0887 C   0  0  0  0  0
    7.3497  -30.5411  -10.6368 C   0  0  0  0  0
    7.0920  -30.6922   -9.1365 C   0  0  0  0  0
    6.2868  -31.3231  -11.4152 C   0  0  0  0  0
    9.8659  -28.5675  -11.3422 C   0  0  0  0  0
    9.8743  -28.9775  -12.5048 O   0  0  0  0  0
   11.0677  -28.1819  -10.7968 N   0  0  0  0  0
   11.5965  -28.7107   -9.5206 C   0  0  0  0  0
   10.8851  -28.2326   -8.2595 C   0  0  0  0  0
   11.8613  -28.3169   -7.1104 C   0  0  0  0  0
   12.3437  -29.3744   -6.7219 O   0  0  0  0  0
   12.1970  -27.1327   -6.5310 N   0  0  0  0  0
   11.5687  -30.2383   -9.6753 C   0  0  0  0  0
   10.5600  -30.8834   -9.3711 O   0  0  0  0  0
   12.5531  -30.8971  -10.3485 N   0  0  0  0  0
   13.9638  -30.5553  -10.6037 C   0  0  0  0  0
   14.1923  -29.2993  -11.4629 C   0  0  0  0  0
   15.6082  -29.2184  -12.0728 C   0  0  0  0  0
   15.7013  -30.0279  -13.3672 C   0  0  0  0  0
   15.9933  -27.7622  -12.3452 C   0  0  0  0  0
   14.6503  -30.4877   -9.2232 C   0  0  0  0  0
   14.9494  -29.4289   -8.6711 O   0  0  0  0  0
   14.7862  -31.6682   -8.5251 N   0  0  0  0  0
   15.8730  -32.6210   -8.8404 C   0  0  0  0  0
   15.3354  -34.0615   -9.0374 C   0  0  0  0  0
   14.3072  -34.2255  -10.1562 C   0  0  0  0  0
   16.4764  -35.0666   -9.2282 C   0  0  0  0  0
   16.8205  -32.1245   -9.9584 C   0  0  0  0  0
   16.5685  -32.3041  -11.1526 O   0  0  0  0  0
   17.8927  -31.3336   -9.6808 N   0  0  0  0  0
   18.6587  -31.1097   -8.4369 C   0  0  0  0  0
   17.9271  -30.2813   -7.3617 C   0  0  0  0  0
   18.8391  -29.9448   -6.1840 C   0  0  0  0  0
   17.5302  -29.0225   -7.9269 O   0  0  0  0  0
   19.1551  -32.4817   -7.9552 C   0  0  0  0  0
   18.6258  -33.0551   -6.9983 O   0  0  0  0  0
   20.0941  -33.1923   -8.6494 N   0  0  0  0  0
   21.2156  -32.7378   -9.4903 C   0  0  0  0  0
   20.8370  -31.9164  -10.7283 C   0  0  0  0  0
   21.9710  -31.8702  -11.7609 C   0  0  0  0  0
   21.5808  -31.0180  -12.9700 C   0  0  0  0  0
   22.6533  -31.0301  -13.9465 N   0  0  0  0  0
   22.5769  -30.4105  -15.1444 C   0  0  0  0  0
   21.5474  -29.9386  -15.7404 N   0  0  0  0  0
   23.7819  -30.3321  -15.7388 N   0  0  0  0  0
   22.1857  -32.0075   -8.5492 C   0  0  0  0  0
   22.0362  -30.8084   -8.2941 O   0  0  0  0  0
   23.1365  -32.6738   -7.8381 N   0  0  0  0  0
   23.7529  -33.9995   -7.9994 C   0  0  0  0  0
   22.7890  -35.1884   -7.9388 C   0  0  0  0  0
   23.5307  -36.4979   -7.6609 C   0  0  0  0  0
   22.5878  -37.6645   -7.8244 C   0  0  0  0  0
   21.7666  -37.9889   -6.9758 O   0  0  0  0  0
   22.6605  -38.3089   -9.0221 N   0  0  0  0  0
   24.5751  -33.9721   -9.3004 C   0  0  0  0  0
   24.0410  -34.1866  -10.3936 O   0  0  0  0  0
   25.8809  -33.5958   -9.3222 N   0  0  0  0  0
   26.8744  -33.3914   -8.2569 C   0  0  0  0  0
   26.4960  -32.2963   -7.2494 C   0  0  0  0  0
   27.7402  -31.7512   -6.5415 C   0  0  0  0  0
   27.3868  -30.6743   -5.5160 C   0  0  0  0  0
   28.6032  -30.0942   -4.9685 N   0  0  0  0  0
   29.2877  -29.1386   -5.6404 C   0  0  0  0  0
   29.0060  -28.7129   -6.8151 N   0  0  0  0  0
   30.3340  -28.6918   -4.9195 N   0  0  0  0  0
   27.1642  -34.7541   -7.5966 C   0  0  0  0  0
   26.5012  -35.1508   -6.6328 O   0  0  0  0  0
   28.0448  -35.6451   -8.1303 N   0  0  0  0  0
   29.1015  -35.5170   -9.1505 C   0  0  0  0  0
   28.6307  -35.0261  -10.5230 C   0  0  0  0  0
   29.5921  -35.3730  -11.6360 C   0  0  0  0  0
   29.5216  -36.6197  -12.2749 C   0  0  0  0  0
   30.4202  -36.9447  -13.2936 C   0  0  0  0  0
   31.3916  -36.0233  -13.6694 C   0  0  0  0  0
   31.4770  -34.7850  -13.0463 C   0  0  0  0  0
   30.5786  -34.4574  -12.0309 C   0  0  0  0  0
   32.2898  -36.2983  -14.6570 O   0  0  0  0  0
   30.2444  -34.6677   -8.6004 C   0  0  0  0  0
   30.1398  -33.5592   -8.0914 O   0  0  0  0  0
   31.4459  -35.2646   -8.6924 O   0  0  0  0  0
   -3.8923   -7.3980  -23.2896 N   0  0  0  0  0
   -4.7944   -7.6891  -22.3092 C   0  0  0  0  0
   -4.9260   -8.8742  -21.9838 O   0  0  0  0  0
   -5.6963   -6.6241  -21.6457 C   0  0  0  0  0
   -4.9547   -5.4494  -21.0018 C   0  0  0  0  0
   -5.8247   -4.6511  -20.0266 C   0  0  0  0  0
   -5.1011   -3.4026  -19.6001 C   0  0  0  0  0
   -3.9025   -3.2921  -19.4024 O   0  0  0  0  0
   -5.9299   -2.3553  -19.4423 O   0  0  0  0  0
   -6.6873   -6.1687  -22.6227 N   0  0  0  0  0
   -8.0231   -5.9959  -22.5152 C   0  0  0  0  0
   -8.4638   -5.0261  -23.1509 O   0  0  0  0  0
   -9.0185   -6.9581  -21.8009 C   0  0  0  0  0
   -8.4888   -7.9933  -20.8109 C   0  0  0  0  0
   -9.5954   -8.9119  -20.2778 C   0  0  0  0  0
   -9.0615  -10.0064  -19.3942 C   0  0  0  0  0
   -9.4295  -11.1691  -19.4033 O   0  0  0  0  0
   -8.1645   -9.5764  -18.4884 O   0  0  0  0  0
   -9.9778   -6.0933  -21.1101 N   0  0  0  0  0
  -10.9533   -5.2751  -21.5667 C   0  0  0  0  0
  -11.2187   -4.3678  -20.7634 O   0  0  0  0  0
  -11.8637   -5.4759  -22.8105 C   0  0  0  0  0
  -11.3722   -6.2811  -24.0062 C   0  0  0  0  0
  -11.9263   -7.6960  -23.8263 C   0  0  0  0  0
  -12.9116   -7.6120  -22.6711 C   0  0  0  0  0
  -13.0747   -6.1957  -22.4047 N   0  0  0  0  0
  -14.2042   -5.7620  -21.7435 C   0  0  0  0  0
  -14.9890   -6.6023  -21.2777 O   0  0  0  0  0
  -14.6546   -4.2800  -21.7429 C   0  0  0  0  0
  -13.7396   -3.1979  -21.1802 C   0  0  0  0  0
  -14.4709   -1.9640  -21.0903 O   0  0  0  0  0
  -15.1414   -3.8949  -23.1017 N   0  0  0  0  0
   -1.5297   -3.7214  -21.2559 H   0  0  0  0  0
   -1.1231   -2.3572  -22.3024 H   0  0  0  0  0
   -0.1998   -3.8670  -22.4194 H   0  0  0  0  0
   -3.1628   -3.5123  -23.1040 H   0  0  0  0  0
   -0.8162   -4.0065  -25.0132 H   0  0  0  0  0
   -1.5390   -2.4201  -24.7027 H   0  0  0  0  0
   -2.5016   -3.6796  -25.4560 H   0  0  0  0  0
   -2.3378   -5.7639  -22.1440 H   0  0  0  0  0
   -1.3665   -5.9362  -23.5677 H   0  0  0  0  0
   -4.3561   -5.4484  -23.7358 H   0  0  0  0  0
   -2.8023   -6.8789  -27.1360 H   0  0  0  0  0
   -1.1901   -8.2545  -26.8984 H   0  0  0  0  0
   -0.7156   -7.9763  -23.9183 H   0  0  0  0  0
   -0.0987   -6.7565  -25.0835 H   0  0  0  0  0
    1.3247   -8.5242  -24.5970 H   0  0  0  0  0
   -0.4871  -10.3291  -25.7546 H   0  0  0  0  0
   -2.9789  -11.8814  -25.1836 H   0  0  0  0  0
   -0.3303  -12.9466  -26.3370 H   0  0  0  0  0
   -1.6707  -12.4575  -27.3641 H   0  0  0  0  0
   -3.1525  -14.1425  -26.2568 H   0  0  0  0  0
   -1.7965  -14.6609  -25.2620 H   0  0  0  0  0
   -0.4913  -15.2931  -27.2607 H   0  0  0  0  0
   -1.7890  -14.7730  -28.3226 H   0  0  0  0  0
   -1.9325  -16.9254  -26.2781 H   0  0  0  0  0
   -3.7926  -15.3173  -28.6268 H   0  0  0  0  0
   -3.0960  -18.7283  -27.1615 H   0  0  0  0  0
   -4.6758  -18.3011  -27.4791 H   0  0  0  0  0
   -2.7150  -13.3976  -23.4395 H   0  0  0  0  0
   -0.2595  -13.1524  -21.8492 H   0  0  0  0  0
   -2.2509  -11.9836  -20.6665 H   0  0  0  0  0
   -1.2282  -13.0890  -19.7906 H   0  0  0  0  0
   -2.6005  -13.6076  -18.0021 H   0  0  0  0  0
   -4.5874  -14.7413  -17.0936 H   0  0  0  0  0
   -6.1629  -15.1691  -21.0700 H   0  0  0  0  0
   -4.2090  -14.0469  -21.9900 H   0  0  0  0  0
   -7.2169  -15.8277  -19.1760 H   0  0  0  0  0
   -0.5850  -16.8311  -21.8286 H   0  0  0  0  0
    1.0054  -16.6852  -20.3563 H   0  0  0  0  0
    1.1010  -13.7020  -19.9304 H   0  0  0  0  0
    1.6740  -14.3716  -21.4469 H   0  0  0  0  0
    3.5940  -15.8894  -21.5710 H   0  0  0  0  0
    5.6495  -16.7238  -20.4811 H   0  0  0  0  0
    4.2802  -15.1867  -16.7034 H   0  0  0  0  0
    2.2352  -14.3458  -17.7705 H   0  0  0  0  0
    6.2190  -16.3117  -17.0255 H   0  0  0  0  0
   -1.5266  -16.7530  -17.7213 H   0  0  0  0  0
   -1.7134  -18.8754  -18.5314 H   0  0  0  0  0
   -3.5545  -17.6242  -19.4242 H   0  0  0  0  0
   -3.0458  -18.8409  -20.6066 H   0  0  0  0  0
   -2.6440  -17.1419  -20.8489 H   0  0  0  0  0
    1.4465  -19.5638  -20.2738 H   0  0  0  0  0
    2.1766  -19.7391  -18.1629 H   0  0  0  0  0
   -0.4760  -19.0935  -16.8331 H   0  0  0  0  0
    0.8360  -17.9199  -17.0818 H   0  0  0  0  0
    2.1888  -19.4570  -15.9205 H   0  0  0  0  0
    0.9498  -23.1368  -18.1859 H   0  0  0  0  0
    3.1316  -23.3885  -17.9833 H   0  0  0  0  0
    3.8114  -20.5974  -18.9366 H   0  0  0  0  0
    3.1335  -21.7696  -20.0530 H   0  0  0  0  0
    5.5837  -22.3801  -18.3228 H   0  0  0  0  0
    4.6158  -23.5657  -20.9867 H   0  0  0  0  0
    4.4779  -24.3629  -19.4150 H   0  0  0  0  0
    6.0711  -24.0449  -20.0998 H   0  0  0  0  0
    5.5384  -21.1532  -21.1294 H   0  0  0  0  0
    6.9793  -21.7253  -20.2687 H   0  0  0  0  0
    6.0686  -20.3456  -19.6427 H   0  0  0  0  0
    3.2727  -21.9482  -14.6174 H   0  0  0  0  0
    3.0276  -24.1228  -14.1764 H   0  0  0  0  0
    2.3699  -24.9835  -17.0077 H   0  0  0  0  0
    1.1555  -24.2864  -15.9332 H   0  0  0  0  0
    1.7084  -26.0370  -14.2253 H   0  0  0  0  0
    2.9099  -26.7211  -15.3122 H   0  0  0  0  0
    1.1612  -27.1944  -17.0076 H   0  0  0  0  0
   -0.0844  -26.4840  -15.9870 H   0  0  0  0  0
    0.6905  -29.0779  -15.9428 H   0  0  0  0  0
   -0.3993  -26.7197  -13.7598 H   0  0  0  0  0
    0.7592  -30.3044  -13.9319 H   0  0  0  0  0
   -0.5942  -29.9440  -13.0344 H   0  0  0  0  0
    6.5381  -24.1428  -15.2529 H   0  0  0  0  0
    6.7762  -23.8963  -13.0587 H   0  0  0  0  0
    3.8292  -23.2173  -12.6410 H   0  0  0  0  0
    5.1548  -22.0871  -12.7806 H   0  0  0  0  0
    6.8796  -22.0247  -10.3957 H   0  0  0  0  0
    4.4857  -24.5879   -8.1250 H   0  0  0  0  0
    3.6342  -24.6926  -10.5178 H   0  0  0  0  0
    5.9671  -27.4534  -12.8948 H   0  0  0  0  0
    8.1466  -27.5161  -13.2434 H   0  0  0  0  0
    8.4095  -24.6156  -14.1331 H   0  0  0  0  0
    7.8916  -25.9004  -15.2040 H   0  0  0  0  0
    9.4500  -27.6992  -15.8754 H   0  0  0  0  0
   11.7972  -28.2793  -16.2914 H   0  0  0  0  0
   13.0667  -25.1196  -13.6621 H   0  0  0  0  0
   10.7086  -24.5208  -13.2315 H   0  0  0  0  0
   13.9483  -27.7197  -15.8806 H   0  0  0  0  0
    8.6648  -26.2779   -9.8376 H   0  0  0  0  0
    8.6871  -28.4650   -9.5365 H   0  0  0  0  0
    7.3093  -29.0643  -12.1807 H   0  0  0  0  0
    6.4228  -28.5840  -10.7431 H   0  0  0  0  0
    8.3230  -30.9869  -10.8719 H   0  0  0  0  0
    6.1397  -30.2328   -8.8500 H   0  0  0  0  0
    7.8831  -30.2309   -8.5399 H   0  0  0  0  0
    7.0524  -31.7505   -8.8562 H   0  0  0  0  0
    5.2842  -30.9216  -11.2328 H   0  0  0  0  0
    6.2891  -32.3789  -11.1241 H   0  0  0  0  0
    6.4805  -31.2766  -12.4922 H   0  0  0  0  0
   11.7531  -28.2591  -11.5400 H   0  0  0  0  0
   12.6271  -28.3640   -9.4638 H   0  0  0  0  0
   10.0220  -28.8434   -7.9803 H   0  0  0  0  0
   10.5425  -27.1985   -8.3775 H   0  0  0  0  0
   11.9065  -26.2294   -6.8802 H   0  0  0  0  0
   12.8905  -27.1548   -5.7926 H   0  0  0  0  0
   12.3448  -31.8874  -10.3785 H   0  0  0  0  0
   14.3440  -31.4195  -11.1495 H   0  0  0  0  0
   14.0408  -28.3973  -10.8659 H   0  0  0  0  0
   13.4549  -29.2707  -12.2742 H   0  0  0  0  0
   16.3380  -29.6099  -11.3582 H   0  0  0  0  0
   15.0453  -29.6143  -14.1410 H   0  0  0  0  0
   15.4144  -31.0715  -13.2111 H   0  0  0  0  0
   16.7254  -30.0179  -13.7553 H   0  0  0  0  0
   15.2745  -27.2759  -13.0094 H   0  0  0  0  0
   16.9841  -27.6996  -12.8074 H   0  0  0  0  0
   16.0269  -27.1911  -11.4110 H   0  0  0  0  0
   14.8069  -31.4413   -7.5356 H   0  0  0  0  0
   16.4534  -32.6643   -7.9188 H   0  0  0  0  0
   14.8209  -34.3391   -8.1063 H   0  0  0  0  0
   14.7039  -33.9432  -11.1342 H   0  0  0  0  0
   13.4154  -33.6301   -9.9540 H   0  0  0  0  0
   13.9800  -35.2692  -10.2254 H   0  0  0  0  0
   17.0130  -34.8996  -10.1674 H   0  0  0  0  0
   16.0883  -36.0911   -9.2457 H   0  0  0  0  0
   17.1957  -35.0031   -8.4059 H   0  0  0  0  0
   18.3187  -30.9698  -10.5222 H   0  0  0  0  0
   19.5216  -30.5134   -8.7394 H   0  0  0  0  0
   17.0357  -30.7819   -6.9770 H   0  0  0  0  0
   19.7268  -29.3962   -6.5189 H   0  0  0  0  0
   19.1633  -30.8391   -5.6453 H   0  0  0  0  0
   18.3176  -29.2900   -5.4770 H   0  0  0  0  0
   16.5841  -29.0936   -8.1815 H   0  0  0  0  0
   20.2468  -34.0806   -8.1854 H   0  0  0  0  0
   21.6741  -33.6509   -9.8615 H   0  0  0  0  0
   20.5887  -30.8848  -10.4679 H   0  0  0  0  0
   19.9576  -32.3650  -11.2048 H   0  0  0  0  0
   22.2100  -32.8877  -12.0935 H   0  0  0  0  0
   22.8804  -31.4629  -11.3022 H   0  0  0  0  0
   21.3814  -29.9875  -12.6540 H   0  0  0  0  0
   20.6648  -31.4201  -13.4176 H   0  0  0  0  0
   23.5715  -30.9083  -13.5309 H   0  0  0  0  0
   20.7187  -30.0885  -15.1656 H   0  0  0  0  0
   24.2588  -31.2242  -15.7613 H   0  0  0  0  0
   23.6591  -29.9776  -16.6832 H   0  0  0  0  0
   23.6386  -32.0296   -7.2378 H   0  0  0  0  0
   24.4152  -34.0942   -7.1421 H   0  0  0  0  0
   22.2283  -35.3095   -8.8691 H   0  0  0  0  0
   22.0498  -35.0264   -7.1444 H   0  0  0  0  0
   23.9288  -36.5163   -6.6406 H   0  0  0  0  0
   24.3803  -36.6209   -8.3419 H   0  0  0  0  0
   23.2869  -38.0391   -9.7669 H   0  0  0  0  0
   22.0258  -39.0821   -9.1780 H   0  0  0  0  0
   26.2292  -33.5475  -10.2719 H   0  0  0  0  0
   27.7706  -33.0499   -8.7759 H   0  0  0  0  0
   25.8024  -32.6625   -6.4876 H   0  0  0  0  0
   25.9976  -31.4710   -7.7732 H   0  0  0  0  0
   28.4291  -31.3465   -7.2925 H   0  0  0  0  0
   28.2731  -32.5664   -6.0365 H   0  0  0  0  0
   26.8169  -31.1306   -4.6984 H   0  0  0  0  0
   26.7485  -29.8974   -5.9531 H   0  0  0  0  0
   28.5333  -29.8919   -3.9780 H   0  0  0  0  0
   29.6608  -27.9771   -7.0806 H   0  0  0  0  0
   30.7739  -29.4309   -4.3840 H   0  0  0  0  0
   31.0224  -28.1760   -5.4521 H   0  0  0  0  0
   28.1073  -36.4737   -7.5477 H   0  0  0  0  0
   29.4805  -36.5429   -9.2509 H   0  0  0  0  0
   28.4883  -33.9410  -10.5363 H   0  0  0  0  0
   27.6532  -35.4643  -10.7627 H   0  0  0  0  0
   28.7639  -37.3457  -11.9880 H   0  0  0  0  0
   30.3473  -37.9131  -13.7782 H   0  0  0  0  0
   32.2409  -34.0753  -13.3527 H   0  0  0  0  0
   30.6577  -33.4816  -11.5563 H   0  0  0  0  0
   32.1056  -37.1844  -15.0094 H   0  0  0  0  0
   32.0802  -34.6280   -8.3010 H   0  0  0  0  0
   -3.5713   -8.2557  -23.7395 H   0  0  0  0  0
   -6.1957   -7.1373  -20.8283 H   0  0  0  0  0
   -4.5986   -4.7526  -21.7641 H   0  0  0  0  0
   -4.0686   -5.8183  -20.4723 H   0  0  0  0  0
   -6.0661   -5.2390  -19.1361 H   0  0  0  0  0
   -6.7616   -4.3582  -20.5119 H   0  0  0  0  0
   -5.3499   -1.6086  -19.1844 H   0  0  0  0  0
   -6.3351   -5.4990  -23.2975 H   0  0  0  0  0
   -9.5246   -7.4958  -22.5986 H   0  0  0  0  0
   -8.0234   -7.4856  -19.9575 H   0  0  0  0  0
   -7.7252   -8.6145  -21.2919 H   0  0  0  0  0
  -10.1116   -9.3887  -21.1189 H   0  0  0  0  0
  -10.3381   -8.3523  -19.6992 H   0  0  0  0  0
   -7.9383  -10.3842  -17.9773 H   0  0  0  0  0
   -9.6173   -5.6758  -20.2581 H   0  0  0  0  0
  -12.1267   -4.4733  -23.1595 H   0  0  0  0  0
  -10.2978   -6.2640  -24.1776 H   0  0  0  0  0
  -11.8201   -5.8626  -24.9176 H   0  0  0  0  0
  -12.4295   -8.0181  -24.7453 H   0  0  0  0  0
  -11.1475   -8.4369  -23.6254 H   0  0  0  0  0
  -13.8666   -8.0867  -22.9174 H   0  0  0  0  0
  -12.5065   -8.0862  -21.7703 H   0  0  0  0  0
  -15.5524   -4.2584  -21.1082 H   0  0  0  0  0
  -12.8827   -2.9946  -21.8227 H   0  0  0  0  0
  -13.3983   -3.4526  -20.1736 H   0  0  0  0  0
  -14.9760   -1.9193  -21.9273 H   0  0  0  0  0
  -14.4249   -4.1405  -23.7818 H   0  0  0  0  0
  -15.9348   -4.5042  -23.3162 H   0  0  0  0  0
  1  2  1  0  0  0
  1215  1  0  0  0
  1216  1  0  0  0
  1217  1  0  0  0
  2  4  1  0  0  0
  2  3  1  0  0  0
  2218  1  0  0  0
  3219  1  0  0  0
  3220  1  0  0  0
  3221  1  0  0  0
  4  5  1  0  0  0
  4222  1  0  0  0
  4223  1  0  0  0
  5183  1  0  0  0
  5  6  1  0  0  0
  5224  1  0  0  0
  6  8  1  0  0  0
  6  7  2  0  0  0
  8  9  1  0  0  0
  8225  1  0  0  0
  9 12  1  0  0  0
  9 10  1  0  0  0
  9226  1  0  0  0
 10 11  1  0  0  0
 10227  1  0  0  0
 10228  1  0  0  0
 11229  1  0  0  0
 12 14  1  0  0  0
 12 13  2  0  0  0
 14 15  1  0  0  0
 14230  1  0  0  0
 15 23  1  0  0  0
 15 16  1  0  0  0
 15231  1  0  0  0
 16 17  1  0  0  0
 16232  1  0  0  0
 16233  1  0  0  0
 17 18  1  0  0  0
 17234  1  0  0  0
 17235  1  0  0  0
 18 19  1  0  0  0
 18236  1  0  0  0
 18237  1  0  0  0
 19 20  1  0  0  0
 19238  1  0  0  0
 20 22  1  0  0  0
 20 21  2  0  0  0
 21239  1  0  0  0
 22240  1  0  0  0
 22241  1  0  0  0
 23 25  1  0  0  0
 23 24  2  0  0  0
 25 26  1  0  0  0
 25242  1  0  0  0
 26 35  1  0  0  0
 26 27  1  0  0  0
 26243  1  0  0  0
 27 28  1  0  0  0
 27244  1  0  0  0
 27245  1  0  0  0
 28 29  2  0  0  0
 28 33  1  0  0  0
 29 30  1  0  0  0
 29246  1  0  0  0
 30 31  2  0  0  0
 30247  1  0  0  0
 31 32  1  0  0  0
 31 34  1  0  0  0
 32 33  2  0  0  0
 32248  1  0  0  0
 33249  1  0  0  0
 34250  1  0  0  0
 35 37  1  0  0  0
 35 36  2  0  0  0
 37 38  1  0  0  0
 37251  1  0  0  0
 38 47  1  0  0  0
 38 39  1  0  0  0
 38252  1  0  0  0
 39 40  1  0  0  0
 39253  1  0  0  0
 39254  1  0  0  0
 40 41  2  0  0  0
 40 45  1  0  0  0
 41 42  1  0  0  0
 41255  1  0  0  0
 42 43  2  0  0  0
 42256  1  0  0  0
 43 44  1  0  0  0
 43 46  1  0  0  0
 44 45  2  0  0  0
 44257  1  0  0  0
 45258  1  0  0  0
 46259  1  0  0  0
 47 49  1  0  0  0
 47 48  2  0  0  0
 49 50  1  0  0  0
 49260  1  0  0  0
 50 52  1  0  0  0
 50 51  1  0  0  0
 50261  1  0  0  0
 51262  1  0  0  0
 51263  1  0  0  0
 51264  1  0  0  0
 52 54  1  0  0  0
 52 53  2  0  0  0
 54 55  1  0  0  0
 54265  1  0  0  0
 55 58  1  0  0  0
 55 56  1  0  0  0
 55266  1  0  0  0
 56 57  1  0  0  0
 56267  1  0  0  0
 56268  1  0  0  0
 57269  1  0  0  0
 58 60  1  0  0  0
 58 59  2  0  0  0
 60 61  1  0  0  0
 60270  1  0  0  0
 61 66  1  0  0  0
 61 62  1  0  0  0
 61271  1  0  0  0
 62 63  1  0  0  0
 62272  1  0  0  0
 62273  1  0  0  0
 63 65  1  0  0  0
 63 64  1  0  0  0
 63274  1  0  0  0
 64275  1  0  0  0
 64276  1  0  0  0
 64277  1  0  0  0
 65278  1  0  0  0
 65279  1  0  0  0
 65280  1  0  0  0
 66 68  1  0  0  0
 66 67  2  0  0  0
 68 69  1  0  0  0
 68281  1  0  0  0
 69 77  1  0  0  0
 69 70  1  0  0  0
 69282  1  0  0  0
 70 71  1  0  0  0
 70283  1  0  0  0
 70284  1  0  0  0
 71 72  1  0  0  0
 71285  1  0  0  0
 71286  1  0  0  0
 72 73  1  0  0  0
 72287  1  0  0  0
 72288  1  0  0  0
 73 74  1  0  0  0
 73289  1  0  0  0
 74 76  1  0  0  0
 74 75  2  0  0  0
 75290  1  0  0  0
 76291  1  0  0  0
 76292  1  0  0  0
 77 79  1  0  0  0
 77 78  2  0  0  0
 79 80  1  0  0  0
 79293  1  0  0  0
 80 87  1  0  0  0
 80 81  1  0  0  0
 80294  1  0  0  0
 81 82  1  0  0  0
 81295  1  0  0  0
 81296  1  0  0  0
 82 83  2  0  0  0
 82 86  1  0  0  0
 83 84  1  0  0  0
 83297  1  0  0  0
 84 85  2  0  0  0
 85 86  1  0  0  0
 85298  1  0  0  0
 86299  1  0  0  0
 87 89  1  0  0  0
 87 88  2  0  0  0
 89 90  1  0  0  0
 89300  1  0  0  0
 90 99  1  0  0  0
 90 91  1  0  0  0
 90301  1  0  0  0
 91 92  1  0  0  0
 91302  1  0  0  0
 91303  1  0  0  0
 92 93  2  0  0  0
 92 97  1  0  0  0
 93 94  1  0  0  0
 93304  1  0  0  0
 94 95  2  0  0  0
 94305  1  0  0  0
 95 96  1  0  0  0
 95 98  1  0  0  0
 96 97  2  0  0  0
 96306  1  0  0  0
 97307  1  0  0  0
 98308  1  0  0  0
 99101  1  0  0  0
 99100  2  0  0  0
101102  1  0  0  0
101309  1  0  0  0
102107  1  0  0  0
102103  1  0  0  0
102310  1  0  0  0
103104  1  0  0  0
103311  1  0  0  0
103312  1  0  0  0
104106  1  0  0  0
104105  1  0  0  0
104313  1  0  0  0
105314  1  0  0  0
105315  1  0  0  0
105316  1  0  0  0
106317  1  0  0  0
106318  1  0  0  0
106319  1  0  0  0
107109  1  0  0  0
107108  2  0  0  0
109110  1  0  0  0
109320  1  0  0  0
110115  1  0  0  0
110111  1  0  0  0
110321  1  0  0  0
111112  1  0  0  0
111322  1  0  0  0
111323  1  0  0  0
112114  1  0  0  0
112113  2  0  0  0
114324  1  0  0  0
114325  1  0  0  0
115117  1  0  0  0
115116  2  0  0  0
117118  1  0  0  0
117326  1  0  0  0
118123  1  0  0  0
118119  1  0  0  0
118327  1  0  0  0
119120  1  0  0  0
119328  1  0  0  0
119329  1  0  0  0
120122  1  0  0  0
120121  1  0  0  0
120330  1  0  0  0
121331  1  0  0  0
121332  1  0  0  0
121333  1  0  0  0
122334  1  0  0  0
122335  1  0  0  0
122336  1  0  0  0
123125  1  0  0  0
123124  2  0  0  0
125126  1  0  0  0
125337  1  0  0  0
126130  1  0  0  0
126127  1  0  0  0
126338  1  0  0  0
127129  1  0  0  0
127128  1  0  0  0
127339  1  0  0  0
128340  1  0  0  0
128341  1  0  0  0
128342  1  0  0  0
129343  1  0  0  0
129344  1  0  0  0
129345  1  0  0  0
130132  1  0  0  0
130131  2  0  0  0
132133  1  0  0  0
132346  1  0  0  0
133137  1  0  0  0
133134  1  0  0  0
133347  1  0  0  0
134136  1  0  0  0
134135  1  0  0  0
134348  1  0  0  0
135349  1  0  0  0
135350  1  0  0  0
135351  1  0  0  0
136352  1  0  0  0
137139  1  0  0  0
137138  2  0  0  0
139140  1  0  0  0
139353  1  0  0  0
140148  1  0  0  0
140141  1  0  0  0
140354  1  0  0  0
141142  1  0  0  0
141355  1  0  0  0
141356  1  0  0  0
142143  1  0  0  0
142357  1  0  0  0
142358  1  0  0  0
143144  1  0  0  0
143359  1  0  0  0
143360  1  0  0  0
144145  1  0  0  0
144361  1  0  0  0
145147  1  0  0  0
145146  2  0  0  0
146362  1  0  0  0
147363  1  0  0  0
147364  1  0  0  0
148150  1  0  0  0
148149  2  0  0  0
150151  1  0  0  0
150365  1  0  0  0
151157  1  0  0  0
151152  1  0  0  0
151366  1  0  0  0
152153  1  0  0  0
152367  1  0  0  0
152368  1  0  0  0
153154  1  0  0  0
153369  1  0  0  0
153370  1  0  0  0
154156  1  0  0  0
154155  2  0  0  0
156371  1  0  0  0
156372  1  0  0  0
157159  1  0  0  0
157158  2  0  0  0
159160  1  0  0  0
159373  1  0  0  0
160168  1  0  0  0
160161  1  0  0  0
160374  1  0  0  0
161162  1  0  0  0
161375  1  0  0  0
161376  1  0  0  0
162163  1  0  0  0
162377  1  0  0  0
162378  1  0  0  0
163164  1  0  0  0
163379  1  0  0  0
163380  1  0  0  0
164165  1  0  0  0
164381  1  0  0  0
165167  1  0  0  0
165166  2  0  0  0
166382  1  0  0  0
167383  1  0  0  0
167384  1  0  0  0
168170  1  0  0  0
168169  2  0  0  0
170171  1  0  0  0
170385  1  0  0  0
171180  1  0  0  0
171172  1  0  0  0
171386  1  0  0  0
172173  1  0  0  0
172387  1  0  0  0
172388  1  0  0  0
173174  2  0  0  0
173178  1  0  0  0
174175  1  0  0  0
174389  1  0  0  0
175176  2  0  0  0
175390  1  0  0  0
176177  1  0  0  0
176179  1  0  0  0
177178  2  0  0  0
177391  1  0  0  0
178392  1  0  0  0
179393  1  0  0  0
180182  1  0  0  0
180181  2  0  0  0
182394  1  0  0  0
183184  1  0  0  0
183395  1  0  0  0
184186  1  0  0  0
184185  2  0  0  0
186192  1  0  0  0
186187  1  0  0  0
186396  1  0  0  0
187188  1  0  0  0
187397  1  0  0  0
187398  1  0  0  0
188189  1  0  0  0
188399  1  0  0  0
188400  1  0  0  0
189191  1  0  0  0
189190  2  0  0  0
191401  1  0  0  0
192193  1  0  0  0
192402  1  0  0  0
193195  1  0  0  0
193194  2  0  0  0
195201  1  0  0  0
195196  1  0  0  0
195403  1  0  0  0
196197  1  0  0  0
196404  1  0  0  0
196405  1  0  0  0
197198  1  0  0  0
197406  1  0  0  0
197407  1  0  0  0
198200  1  0  0  0
198199  2  0  0  0
200408  1  0  0  0
201202  1  0  0  0
201409  1  0  0  0
202204  1  0  0  0
202203  2  0  0  0
204208  1  0  0  0
204205  1  0  0  0
204410  1  0  0  0
205206  1  0  0  0
205411  1  0  0  0
205412  1  0  0  0
206207  1  0  0  0
206413  1  0  0  0
206414  1  0  0  0
207208  1  0  0  0
207415  1  0  0  0
207416  1  0  0  0
208209  1  0  0  0
209211  1  0  0  0
209210  2  0  0  0
211214  1  0  0  0
211212  1  0  0  0
211417  1  0  0  0
212213  1  0  0  0
212418  1  0  0  0
212419  1  0  0  0
213420  1  0  0  0
214421  1  0  0  0
214422  1  0  0  0
M  END

>  <Chemical Name>
PYY13-36, porcine

>  <PubChem CID>
91898411

>  <Formula>
C135H208N40O39

>  <Molecular Weight>
3015.390000

>  <IUPAC Name>


>  <XlogP>
-8.3

>  <Hydrogen Bond Donors>
49

>  <Hydrogen Bond Acceptors>
45

>  <Canonical SMILES>
CC(C)CC(C(=O)NC(CO)C(=O)NC(CCCNC(=N)N)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)NC(C)C(=O)NC(CO)C(=O)NC(CC(C)C)C(=O)NC(CCCNC(=N)N)C(=O)NC(CC3=CN=CN3)C(=O)NC(CC4=CC=C(C=C4)O)C(=O)NC(CC(C)C)C(=O)NC(CC(=O)N)C(=O)NC(CC(C)C)C(=O)NC(C(C)C)C(=O)NC(C(C)O)C(=O)NC(CCCNC(=N)N)C(=O)NC(CCC(=O)N)C(=O)NC(CCCNC(=N)N)C(=O)NC(CC5=CC=C(C=C5)O)C(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C6CCCN6C(=O)C(CO)N

>  <Isomeric SMILES>
C[C@H]([C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CC3=CN=CN3)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H](CC5=CC=C(C=C5)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]6CCCN6C(=O)[C@H](CO)N)O

>  <InChI Std. ID>
InChI=1S/C135H208N40O39/c1-65(2)50-89(164-126(208)99(62-177)171-108(190)70(11)153-116(198)93(54-72-23-31-77(180)32-24-72)166-121(203)94(55-73-25-33-78(181)34-26-73)165-110(192)83(19-14-46-149-133(141)142)156-125(207)100(63-178)172-119(201)91(52-67(5)6)161-115(197)87(40-43-104(186)187)158-114(196)88(41-44-105(188)189)159-127(209)101-22-17-49-175(101)130(212)81(136)61-176)117(199)155-82(18-13-45-148-132(139)140)111(193)168-96(58-76-60-147-64-152-76)122(204)167-95(56-74-27-35-79(182)36-28-74)120(202)162-90(51-66(3)4)118(200)169-97(59-103(138)185)123(205)163-92(53-68(7)8)124(206)173-106(69(9)10)128(210)174-107(71(12)179)129(211)160-85(21-16-48-151-135(145)146)109(191)157-86(39-42-102(137)184)113(195)154-84(20-15-47-150-134(143)144)112(194)170-98(131(213)214)57-75-29-37-80(183)38-30-75/h23-38,60,64-71,81-101,106-107,176-183H,13-22,39-59,61-63,136H2,1-12H3,(H2,137,184)(H2,138,185)(H,147,152)(H,153,198)(H,154,195)(H,155,199)(H,156,207)(H,157,191)(H,158,196)(H,159,209)(H,160,211)(H,161,197)(H,162,202)(H,163,205)(H,164,208)(H,165,192)(H,166,203)(H,167,204)(H,168,193)(H,169,200)(H,170,194)(H,171,190)(H,172,201)(H,173,206)(H,174,210)(H,186,187)(H,188,189)(H,213,214)(H4,139,140,148)(H4,141,142,149)(H4,143,144,150)(H4,145,146,151)/t70-,71+,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,106-,107-/m0/s1

>  <InChI Key>
IAZLNMARDOOODL-PRZASUQOSA-N

