HMDB0014476 RDKit 3D Ipratropium bromide 54 56 0 0 0 0 0 0 0 0999 V2000 -4.2057 2.1439 0.1172 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0326 0.6240 0.2713 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0353 -0.0162 -0.6229 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6847 0.2278 0.1232 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.0777 0.3309 1.4426 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4484 -1.0321 -0.5112 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4918 -0.7881 -2.0178 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2031 0.6673 -2.1643 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8947 1.1229 -0.7321 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4236 0.9178 -0.5299 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0414 -0.5252 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2705 -0.7973 -0.2948 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3314 -1.1342 -1.0878 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0715 -1.1984 -2.3196 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7007 -1.4086 -0.5536 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6054 -2.6225 0.3463 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7465 -2.4360 1.4032 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2538 -0.2422 0.1593 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5625 0.2877 1.2193 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 1.3916 1.9119 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2681 1.9347 1.5037 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9552 1.3957 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4480 0.2982 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0463 -1.5165 -0.2362 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1964 2.4582 -0.9262 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5487 2.7015 0.7921 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2552 2.3377 0.4885 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3934 0.4317 1.3285 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9943 -1.1199 -0.6344 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0530 0.2192 -0.1822 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0763 0.4399 -1.6364 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1179 1.4269 1.7021 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0571 0.0076 1.5199 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7022 -0.1945 2.2027 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1357 -1.8393 -0.2014 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -1.4301 -2.5507 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4524 -1.1133 -2.4673 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0279 1.2173 -2.6132 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2995 0.8732 -2.7846 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1431 2.1732 -0.5879 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0325 1.3612 0.4054 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0794 1.5286 -1.3406 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0173 -0.6546 -1.8381 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4009 -1.6802 -1.3665 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6173 -2.9198 0.7073 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2479 -3.4608 -0.2896 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2882 -2.3566 2.2296 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6196 -0.0958 1.5794 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5131 1.8038 2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6291 2.7966 2.0678 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8914 1.8691 0.1715 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0341 -0.0794 -1.0715 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8932 -1.8802 0.7931 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9236 -2.4463 -0.8728 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 16 17 1 0 15 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 11 24 1 0 9 4 1 0 23 18 1 0 24 6 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 0 3 29 1 0 3 30 1 0 3 31 1 0 5 32 1 0 5 33 1 0 5 34 1 0 6 35 1 6 7 36 1 0 7 37 1 0 8 38 1 0 8 39 1 0 9 40 1 6 10 41 1 0 10 42 1 0 11 43 1 0 15 44 1 0 16 45 1 0 16 46 1 0 17 47 1 0 19 48 1 0 20 49 1 0 21 50 1 0 22 51 1 0 23 52 1 0 24 53 1 0 24 54 1 0 M CHG 1 4 1 M END