HMDB0005768 RDKit 3D Kyotorphin 47 47 0 0 0 0 0 0 0 0999 V2000 5.3091 -3.4907 1.8346 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3702 -2.2474 1.5306 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3532 -1.4269 2.1119 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4501 -1.6981 0.6109 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9714 -0.3383 0.7689 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9928 0.0272 -0.3389 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 1.4521 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5736 1.9332 -1.1301 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3899 1.1220 -1.1481 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8829 1.6462 -0.8306 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9946 2.8584 -0.5214 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1289 0.8377 -0.8385 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8708 -0.5408 -1.2097 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6972 0.8588 0.5417 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9311 0.1103 0.7192 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 0.7808 0.5147 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3222 0.0729 0.6823 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3339 -1.2616 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5156 -1.9600 1.2072 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1309 -1.9239 1.2443 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9411 -1.2211 1.0781 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2036 2.0425 -2.4725 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7325 1.4771 -3.4967 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3599 2.7882 -2.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6169 -4.1602 1.4514 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3165 -1.4160 1.7287 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1317 -0.8245 2.9267 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1276 -2.2899 -0.1764 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5055 -0.2339 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8284 0.3484 0.7093 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1187 -0.6460 -0.2332 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4562 -0.0923 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4178 2.1464 -0.0994 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0565 1.5176 0.8931 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2778 2.9612 -0.8378 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4513 0.1059 -1.4024 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7891 1.2850 -1.6024 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7565 -1.0806 -1.0913 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1725 -0.9847 -0.5688 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8661 1.9262 0.8647 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9326 0.4492 1.2309 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1617 1.8285 0.2316 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2575 0.5984 0.5222 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9692 -2.4569 0.4597 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0798 -2.9703 1.5275 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -1.6819 1.2215 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2812 3.7717 -2.8803 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 18 20 1 0 20 21 2 0 8 22 1 0 22 23 2 0 22 24 1 0 21 15 1 0 1 25 1 0 3 26 1 0 3 27 1 0 4 28 1 0 5 29 1 0 5 30 1 0 6 31 1 0 6 32 1 0 7 33 1 0 7 34 1 0 8 35 1 1 9 36 1 0 12 37 1 6 13 38 1 0 13 39 1 0 14 40 1 0 14 41 1 0 16 42 1 0 17 43 1 0 19 44 1 0 20 45 1 0 21 46 1 0 24 47 1 0 M END