HMDB0014354 RDKit 3D Trospium 59 63 0 0 0 0 0 0 0 0999 V2000 1.2332 -0.7052 2.4403 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6132 -0.3209 1.3011 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5974 -0.0489 0.3942 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7787 -0.1866 0.7049 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4207 -1.2644 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -0.9508 -0.6536 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5708 -0.1146 -1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6704 1.2954 -1.4355 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 1.1645 0.0874 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 1.1329 0.6627 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5436 -0.0751 0.1859 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.7250 -0.5565 1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1719 -0.9687 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8069 -0.7920 0.3041 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8398 0.1169 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0566 -0.1768 0.9734 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7801 -0.5807 2.1188 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4609 -1.0934 -0.1213 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9475 -0.9668 -1.3947 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3302 -1.8199 -2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2459 -2.8371 -2.1511 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7674 -2.9800 -0.8941 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3649 -2.1108 0.0829 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4623 1.2124 0.7096 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7935 1.5138 0.5501 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2247 2.8072 0.3025 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2627 3.7882 0.2213 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9124 3.5392 0.3739 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5408 2.2087 0.6226 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8056 -0.5398 1.7773 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7352 -1.4775 -0.9787 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4808 -2.2284 0.4432 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3628 -1.8515 -0.8407 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2946 -0.3842 -2.6974 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5499 -0.3412 -2.3435 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7196 1.8207 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4857 1.8752 -1.8768 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 2.0240 0.5012 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 1.8329 0.0519 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4639 1.6147 1.6832 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 0.2759 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1132 -1.4758 1.7437 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6996 -0.3884 2.4494 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2875 -2.0381 1.9403 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8221 -0.3815 0.4184 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9009 -1.7512 -0.2419 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1878 1.1675 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8927 -0.0834 -1.4668 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3886 -1.4548 2.3742 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -0.1742 -1.5858 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9541 -1.7561 -3.3996 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5491 -3.5099 -2.9331 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4849 -3.7508 -0.6391 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7824 -2.2275 1.0827 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5240 0.7273 0.6185 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2646 3.0456 0.1773 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5688 4.8253 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1652 4.3124 0.3091 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4806 2.0627 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 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 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 2 16 1 0 16 17 1 0 16 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 16 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 10 4 1 0 15 11 1 0 23 18 1 0 29 24 1 0 11 6 1 0 4 30 1 0 5 31 1 0 5 32 1 0 6 33 1 0 7 34 1 0 7 35 1 0 8 36 1 0 8 37 1 0 9 38 1 0 10 39 1 0 10 40 1 0 12 41 1 0 12 42 1 0 13 43 1 0 13 44 1 0 14 45 1 0 14 46 1 0 15 47 1 0 15 48 1 0 17 49 1 0 19 50 1 0 20 51 1 0 21 52 1 0 22 53 1 0 23 54 1 0 25 55 1 0 26 56 1 0 27 57 1 0 28 58 1 0 29 59 1 0 M CHG 1 11 1 M END