RDKit 3D 57 61 0 0 0 0 0 0 0 0999 V2000 1.9592 -3.5336 -1.1773 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4583 -2.1819 -0.6791 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0741 -2.1191 -0.6198 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7748 -3.0961 -0.8679 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5306 -0.8461 -0.2997 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8636 -0.4036 -0.2062 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9722 -1.1885 -0.4996 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2692 -0.6615 -0.3861 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5097 0.6563 0.0284 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3752 1.4297 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0754 0.9146 0.1982 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 1.1760 0.1345 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0918 2.2865 1.0536 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5174 2.1402 1.6139 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5384 2.1153 0.6062 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1057 1.5147 -0.6241 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9542 0.5079 -0.4627 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1201 -1.8751 1.0113 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6657 -1.0850 0.5816 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8946 -1.5017 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0983 -2.5820 2.0158 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3755 -2.9035 2.4699 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4601 -2.1560 2.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2592 -1.0932 1.1503 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9954 -0.7523 0.6827 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8873 0.2770 -0.1630 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 0.5915 -0.5983 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5308 -0.0441 -0.2601 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 1.7158 -1.5363 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5924 2.5109 -2.0282 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1384 3.5093 -2.9369 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7747 3.4615 -3.1091 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0554 2.2152 -2.1881 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0527 -3.5579 -1.2441 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5667 -3.7365 -2.1806 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6314 -4.3569 -0.5313 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7759 -1.4040 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1848 -0.1699 -0.0518 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8739 -2.2198 -0.8232 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0940 -1.3302 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4790 2.4708 0.6061 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2386 1.5691 0.4284 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0035 3.2314 0.5062 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4005 2.3065 1.9041 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6031 1.2150 2.1967 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7435 2.9741 2.2881 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8074 2.3276 -1.2972 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9757 1.0202 -1.0712 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7132 0.1066 -1.4538 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2699 -0.3168 0.1879 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2601 -3.1797 2.3676 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 -3.7327 3.1589 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4637 -2.3936 2.3802 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1182 -0.5140 0.8166 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6311 2.3711 -1.7471 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7807 4.2243 -3.4389 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1633 4.0964 -3.7366 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 3 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 9 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 2 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 27 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 32 33 1 0 11 6 1 0 17 12 1 0 28 19 2 0 25 20 1 0 33 29 1 0 1 34 1 0 1 35 1 0 1 36 1 0 2 37 1 6 5 38 1 0 7 39 1 0 8 40 1 0 10 41 1 0 11 42 1 0 13 43 1 0 13 44 1 0 14 45 1 0 14 46 1 0 16 47 1 0 16 48 1 0 17 49 1 0 17 50 1 0 21 51 1 0 22 52 1 0 23 53 1 0 24 54 1 0 30 55 1 0 31 56 1 0 32 57 1 0 M END