RDKit 3D 42 45 0 0 0 0 0 0 0 0999 V2000 4.4919 -2.8979 0.1575 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 -2.7538 0.0916 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5319 -1.4865 0.1855 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2787 -0.3465 0.3432 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6807 0.9050 0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3085 1.0333 0.3672 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5707 -0.1062 0.2101 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1312 -1.3555 0.1174 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1644 -2.3466 -0.0374 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0387 -1.6999 -0.4479 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1723 -2.5172 0.0598 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2899 -1.7711 0.7171 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1405 -1.1742 -0.1966 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -0.8280 1.6882 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5803 -0.1548 1.3993 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9073 -0.3209 0.0981 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3637 0.7370 -0.9189 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3354 2.0734 -0.2347 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1041 2.7565 -0.5005 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2569 4.1848 -0.6525 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9388 2.4675 0.4888 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9467 -2.1722 -0.5561 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8593 -2.6048 1.1825 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8196 -3.9044 -0.1357 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3669 -0.4519 0.3957 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3445 1.7499 0.5573 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0753 -1.6357 -1.5673 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6311 -3.0484 -0.8287 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7791 -3.3203 0.7282 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8432 -2.5502 1.3303 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9052 -1.7763 -0.3795 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1949 -0.7036 2.6614 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1949 0.5282 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5878 0.6995 -1.7344 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3244 0.4754 -1.3794 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 2.6772 -0.6684 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5342 2.0328 0.8459 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2714 4.5463 -0.3873 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0889 4.4733 -1.7106 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4894 4.7465 -0.0462 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 2.7585 1.4997 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8082 3.0818 0.1793 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 21 1 0 21 19 1 0 19 20 1 0 19 18 1 0 18 17 1 0 17 16 1 0 16 15 1 1 15 14 2 0 14 12 1 0 12 13 1 0 12 11 1 0 11 10 1 0 10 9 1 0 9 8 1 0 8 7 2 0 8 3 1 0 7 6 1 0 10 16 1 0 7 16 1 0 1 22 1 0 1 23 1 0 1 24 1 0 4 25 1 0 5 26 1 0 21 41 1 0 21 42 1 0 20 38 1 0 20 39 1 0 20 40 1 0 18 36 1 0 18 37 1 0 17 34 1 0 17 35 1 0 15 33 1 0 14 32 1 0 12 30 1 1 13 31 1 0 11 28 1 0 11 29 1 0 10 27 1 6 M END