HMDB0035593 RDKit 3D Rishitin 38 39 0 0 0 0 0 0 0 0999 V2000 3.9805 0.6796 0.8261 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 0.0766 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8944 -0.9067 -0.9707 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7979 0.3652 -0.2015 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4547 1.5419 0.6859 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0438 1.9710 0.3407 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8382 0.8129 0.6518 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4825 -0.4103 0.2754 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9133 -0.8286 0.0133 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6286 -1.3805 0.1268 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2776 -2.5027 -0.8122 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7961 -0.5555 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2815 0.2809 -1.3983 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2752 0.3137 0.7534 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2408 1.2278 0.3294 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 1.0527 1.3931 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 0.4856 0.9381 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5916 1.4228 1.5373 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8042 -1.3104 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2261 -0.3401 -1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2352 -1.7586 -1.2286 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6238 0.7279 -1.2549 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5315 1.3096 1.7596 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1933 2.3472 0.3924 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2058 2.8331 0.9738 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0457 2.1620 -0.7386 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0007 -1.4726 -0.9011 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3284 -1.3902 0.8929 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9155 -1.7603 1.1038 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2291 -3.0131 -1.0784 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -2.1265 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6456 -3.2291 -0.2945 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6301 -1.1644 -0.7467 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4477 1.2424 -1.2016 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7064 -0.3533 1.5248 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9784 0.7808 -0.1189 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 0.7344 2.4368 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3385 2.1346 1.4061 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 8 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 14 16 1 0 9 4 1 0 16 7 1 0 1 17 1 0 1 18 1 0 3 19 1 0 3 20 1 0 3 21 1 0 4 22 1 0 5 23 1 0 5 24 1 0 6 25 1 0 6 26 1 0 9 27 1 0 9 28 1 0 10 29 1 0 11 30 1 0 11 31 1 0 11 32 1 0 12 33 1 0 13 34 1 0 14 35 1 0 15 36 1 0 16 37 1 0 16 38 1 0 M END