HMDB0015600 RDKit 3D Bepotastine 52 54 0 0 0 0 0 0 0 0999 V2000 2.4330 -1.9412 5.8930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7419 -1.4659 4.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3764 -1.6513 5.0321 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4011 -0.7854 3.8138 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4378 -0.1687 2.8542 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5443 0.8917 3.4626 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3241 1.4220 2.4915 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3434 0.5961 1.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0264 1.3624 0.8199 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 1.4452 -0.2907 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 0.1430 -0.6396 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8131 -0.1769 -1.9519 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5742 -0.2795 -2.5383 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8753 0.2516 -3.7736 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1544 0.1624 -4.2988 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1711 -0.4568 -3.6127 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7966 -0.5841 -4.2494 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.8599 -0.9856 -2.3762 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5881 -0.9020 -1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6238 -1.3401 -2.2865 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8669 -1.5395 -1.7488 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5962 -2.6552 -2.1028 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1136 -3.5864 -2.9878 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8632 -3.3559 -3.5081 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1437 -2.2520 -3.1566 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2293 2.1113 0.2155 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0927 2.4759 1.6648 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0101 -2.5814 4.8413 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1045 0.0153 4.1493 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0072 -1.5294 3.2177 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -0.9523 2.4129 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9532 0.2830 1.9673 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1906 1.6993 3.9196 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0477 0.4830 4.3249 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1252 0.4068 2.7244 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9761 -0.3465 1.5014 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3453 2.3650 1.2075 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9753 0.8668 0.5318 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4381 1.9892 -1.1757 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2654 0.7197 -2.4867 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0673 0.7378 -4.3101 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3892 0.5815 -5.2738 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6425 -1.4799 -1.8104 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3463 -1.3170 -0.8752 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3193 -0.8463 -1.0438 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6054 -2.8238 -1.6739 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7185 -4.4345 -3.2311 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4395 -4.0618 -4.2108 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4044 3.0757 -0.3411 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1311 1.4707 0.0926 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0302 2.9849 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6736 3.3091 1.7406 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 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 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 16 18 1 0 18 19 2 0 12 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 10 26 1 0 26 27 1 0 27 7 1 0 19 13 1 0 25 20 1 0 3 28 1 0 4 29 1 0 4 30 1 0 5 31 1 0 5 32 1 0 6 33 1 0 6 34 1 0 8 35 1 0 8 36 1 0 9 37 1 0 9 38 1 0 10 39 1 0 12 40 1 0 14 41 1 0 15 42 1 0 18 43 1 0 19 44 1 0 21 45 1 0 22 46 1 0 23 47 1 0 24 48 1 0 26 49 1 0 26 50 1 0 27 51 1 0 27 52 1 0 M END