HMDB0014322 RDKit 3D Fluvoxamine 43 43 0 0 0 0 0 0 0 0999 V2000 6.1245 -0.4724 0.6248 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7738 -0.8993 0.7001 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0063 0.0038 -0.0362 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5555 -0.4032 -0.1085 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 0.6161 -1.0766 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5546 0.1836 -1.4082 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4539 0.1753 -0.4034 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7811 1.0542 0.4136 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5182 2.2875 0.7964 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 3.2938 -0.1189 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 3.8558 0.7774 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9238 4.8210 0.0578 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3188 -1.0052 -0.3077 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0739 -1.8743 0.7168 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8704 -2.9771 0.8593 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 -3.1787 -0.0296 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7622 -4.3355 0.1803 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0260 -3.9783 0.5474 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.2342 -5.1373 1.1850 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.7507 -5.0228 -1.0323 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.1396 -2.2885 -1.0552 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3372 -1.1792 -1.2052 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7115 -1.2751 1.1531 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4435 -0.4186 -0.4307 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1622 0.5090 1.1423 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 0.0966 -1.0644 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0429 1.0244 0.4271 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4557 -1.3834 -0.5904 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0193 -0.3927 0.8398 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5814 0.8588 -1.8869 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 1.5667 -0.4274 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2653 0.6788 -2.3872 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6821 -0.9423 -1.8236 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3934 2.7944 -1.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3215 4.1285 -0.2565 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7585 4.2243 1.6818 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8693 2.9094 0.9608 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8640 4.5718 -0.2327 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5844 5.7584 0.0046 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -1.6710 1.4318 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7159 -3.6966 1.6484 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9532 -2.4087 -1.7716 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5344 -0.4720 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 3 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 7 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 1 0 17 20 1 0 16 21 1 0 21 22 2 0 22 13 1 0 1 23 1 0 1 24 1 0 1 25 1 0 3 26 1 0 3 27 1 0 4 28 1 0 4 29 1 0 5 30 1 0 5 31 1 0 6 32 1 0 6 33 1 0 10 34 1 0 10 35 1 0 11 36 1 0 11 37 1 0 12 38 1 0 12 39 1 0 14 40 1 0 15 41 1 0 21 42 1 0 22 43 1 0 M END