HMDB0255442 RDKit 3D 1-(2-Methoxyphenyl)-4-(4-(2-phthalimido)butyl)piperazine 56 59 0 0 0 0 0 0 0 0999 V2000 -7.4011 -1.1422 -1.0659 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1232 -0.6963 -0.7414 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7704 0.6075 -0.4634 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7581 1.6082 -0.4995 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4234 2.9231 -0.2253 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1188 3.2199 0.0786 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1374 2.2508 0.1177 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4751 0.9274 -0.1575 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4511 -0.0323 -0.0796 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4072 -0.9645 1.0399 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9624 -0.8899 1.5269 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1034 -1.5870 0.5590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2641 -1.1163 0.6995 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1919 -2.0658 -0.0038 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6372 -1.6362 0.1044 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9195 -0.3113 -0.5376 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3178 0.0433 -0.3608 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 0.8264 0.7237 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1392 1.3217 1.6529 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2975 0.9312 0.5506 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2827 1.5528 1.2846 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5970 1.4833 0.8767 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8970 0.7835 -0.2701 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9363 0.1393 -1.0454 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6300 0.2267 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 -0.3329 -1.1917 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3332 -1.0197 -2.2358 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6315 -1.4502 -0.7774 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3962 -0.1829 -1.0439 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9606 -1.3692 -0.1286 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9822 -0.3931 -1.6477 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3681 -2.0544 -1.7141 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7798 1.4017 -0.7312 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1857 3.7126 -0.2501 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7892 4.2389 0.3061 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1098 2.4742 0.3567 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 -0.6710 1.8731 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6035 -2.0007 0.7709 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9115 -1.4686 2.4662 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6625 0.1396 1.7113 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4817 -1.0729 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3761 -0.0827 0.3221 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1329 -3.0500 0.5596 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9048 -2.2302 -1.0451 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2432 -2.4092 -0.4313 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9362 -1.6281 1.1692 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2813 0.4721 -0.0432 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6448 -0.3228 -1.6157 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0040 2.0941 2.1845 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3803 1.9813 1.4665 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9403 0.7103 -0.6135 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2029 -0.4026 -1.9418 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3007 -2.3348 -1.0021 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8029 -1.5093 -1.4975 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7091 0.6671 -1.0361 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8362 -0.3097 -2.0681 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 12 28 1 0 28 29 1 0 8 3 1 0 29 9 1 0 26 17 1 0 25 20 1 0 1 30 1 0 1 31 1 0 1 32 1 0 4 33 1 0 5 34 1 0 6 35 1 0 7 36 1 0 10 37 1 0 10 38 1 0 11 39 1 0 11 40 1 0 13 41 1 0 13 42 1 0 14 43 1 0 14 44 1 0 15 45 1 0 15 46 1 0 16 47 1 0 16 48 1 0 21 49 1 0 22 50 1 0 23 51 1 0 24 52 1 0 28 53 1 0 28 54 1 0 29 55 1 0 29 56 1 0 M END