HMDB0252997 RDKit 3D 4-(8-Methyl-9H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)benzenamine 37 40 0 0 0 0 0 0 0 0999 V2000 -3.3955 3.0771 1.4344 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2239 2.4055 0.7819 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1051 2.5649 1.3734 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1706 2.0460 0.9848 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3718 0.9116 0.3562 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7294 0.5441 0.0356 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7197 1.2680 0.7288 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0412 1.0553 0.4442 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4801 0.1477 -0.5093 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8619 -0.0151 -0.7444 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4931 -0.5489 -1.1759 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1473 -0.3485 -0.9039 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7024 -0.0167 0.0411 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2803 -1.3421 0.1618 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1373 -2.3825 -0.0996 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4388 -2.0762 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8397 -0.7392 -0.5974 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9918 0.2962 -0.3389 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5898 1.6643 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0874 -3.2865 -0.6871 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3204 -4.3449 -0.1533 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0153 -3.7698 -0.0711 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1062 3.9402 2.0379 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0510 3.4384 0.6097 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9006 2.3239 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4171 1.9977 1.4931 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7709 1.6376 1.0051 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3170 -0.9139 -0.5166 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4212 0.7567 -1.1422 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8155 -1.2655 -1.9276 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -0.8927 -1.4844 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7163 -1.5667 0.5004 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8423 -0.5174 -0.8943 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6876 1.6073 -0.5859 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1769 2.1203 -1.3594 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6696 -4.5286 0.8785 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3334 -5.2481 -0.7947 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 9 11 1 0 11 12 2 0 5 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 16 20 1 0 20 21 1 0 21 22 1 0 19 2 1 0 12 6 1 0 18 13 1 0 22 15 1 0 1 23 1 0 1 24 1 0 1 25 1 0 7 26 1 0 8 27 1 0 10 28 1 0 10 29 1 0 11 30 1 0 12 31 1 0 14 32 1 0 17 33 1 0 19 34 1 0 19 35 1 0 21 36 1 0 21 37 1 0 M END