RDKit 3D 40 40 0 0 0 0 0 0 0 0999 V2000 -0.6459 -1.4173 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7512 -1.3564 -0.6446 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4161 -0.3252 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6642 0.6497 0.6759 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7376 0.5883 0.6744 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3999 -0.4483 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 -0.6237 -0.0539 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5701 0.3067 0.6687 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0571 -0.0589 0.5509 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4734 -0.2874 -0.8974 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2367 -0.1285 -1.0502 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.7323 -1.0556 -0.0304 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5011 -0.5279 -2.4294 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4752 1.2842 -0.7622 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.3124 -1.2380 1.3386 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7815 -0.3826 -0.0459 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5069 0.6183 0.6681 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0178 0.3760 0.5617 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4968 0.4861 -0.8829 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1735 -0.0855 -1.0338 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0770 -1.5210 -0.7867 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5374 0.2843 -2.3989 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8659 0.6710 0.0130 O 0 0 0 0 0 1 0 0 0 0 0 0 5.6592 1.3656 1.3903 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1495 -2.2292 -1.1642 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3243 -2.1212 -1.1625 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1347 1.4742 1.2008 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2796 1.3681 1.1984 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 1.3117 0.2551 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2878 0.2905 1.7287 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6313 0.7509 1.0151 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0324 0.4523 -1.5733 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2121 -1.2958 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2587 -1.4581 1.1551 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 0.6007 1.7302 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2724 1.6144 0.2699 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2514 -0.6123 0.9737 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4896 1.5301 -1.2148 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8941 -0.1156 -1.5701 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6270 1.2653 1.2007 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 2 0 11 14 1 0 9 15 1 0 3 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 2 0 20 23 1 0 18 24 1 0 6 1 1 0 1 25 1 0 2 26 1 0 4 27 1 0 5 28 1 0 8 29 1 0 8 30 1 0 9 31 1 1 10 32 1 0 10 33 1 0 15 34 1 0 17 35 1 0 17 36 1 0 18 37 1 1 19 38 1 0 19 39 1 0 24 40 1 0 M CHG 2 14 -1 23 -1 M END