HMDB0015281 RDKit 3D Cefprozil 46 48 0 0 0 0 0 0 0 0999 V2000 -7.3439 1.5808 0.3137 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4539 0.6747 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2134 0.5008 -0.3068 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8637 0.3163 -0.0943 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1749 -0.5171 -0.9277 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8213 -1.1950 -2.0399 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1819 -1.9521 -2.7871 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1741 -1.0657 -2.3664 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7996 -0.7665 -0.7129 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4757 -0.7575 -1.2195 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0848 -0.4098 -2.3094 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0098 -1.3225 0.0422 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1038 -0.7226 0.7231 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4014 -1.3251 0.5894 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5003 -2.3404 -0.1581 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 -0.8683 1.2423 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4414 -0.0216 2.4074 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5920 -0.2299 0.3534 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8768 -0.0318 0.7936 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8145 0.5971 0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4422 1.0395 -1.2667 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 1.6852 -2.1224 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1624 0.8520 -1.7285 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2483 0.2118 -0.9004 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3509 -1.2558 0.6030 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8196 0.0420 1.7346 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0676 1.0551 0.9604 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1112 2.6599 0.0699 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4058 1.3893 0.1133 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1311 1.4465 1.4119 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0317 0.1520 -1.3199 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2931 1.4715 0.7077 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6885 -1.8778 -2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2913 -2.4311 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0347 0.1454 1.3365 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1230 -1.8061 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8645 -0.4804 3.1538 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2326 0.9597 2.2127 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1684 -0.3744 1.7683 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8357 0.7682 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2848 1.8175 -1.7525 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8377 1.1840 -2.7063 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2501 0.0807 -1.3021 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7622 -2.2473 0.9231 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8334 1.4288 1.6788 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5596 1.9396 0.4695 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 3 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 6 8 1 0 5 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 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 21 23 1 0 23 24 2 0 12 25 1 0 25 26 1 0 26 27 1 0 27 4 1 0 25 9 1 0 24 18 1 0 1 28 1 0 1 29 1 0 1 30 1 0 2 31 1 0 3 32 1 0 8 33 1 0 12 34 1 6 13 35 1 0 16 36 1 1 17 37 1 0 17 38 1 0 19 39 1 0 20 40 1 0 22 41 1 0 23 42 1 0 24 43 1 0 25 44 1 1 27 45 1 0 27 46 1 0 M END