B5V3SG -OEChem-04042105283D 34 35 0 0 0 0 0 0 0999 V2000 -6.3237 -0.0456 -0.0245 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5718 2.3917 0.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6003 -2.3966 0.0104 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9062 0.0133 -0.3865 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5645 0.1290 -1.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8144 -0.0695 1.0336 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8773 0.0653 -1.2018 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0333 -0.0339 0.9277 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -0.0504 1.3877 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6353 -1.2337 0.6852 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 1.1818 0.7287 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5153 -0.0224 0.6107 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 1.1976 0.2872 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9585 -1.2178 0.2438 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6128 -0.0021 0.0448 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5337 0.0675 -0.8767 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6682 -0.0168 -0.0671 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9218 0.0016 0.6139 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4684 2.9790 -1.1987 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5033 -2.9379 -1.3054 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5308 -0.1163 2.4675 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1325 -2.1863 0.8385 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1069 2.1222 0.9163 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0993 -0.1327 2.0036 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2377 0.1172 -2.1478 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8544 -0.9066 1.2211 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8438 0.8869 1.2529 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8944 0.0163 0.1145 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 3.1902 -1.4413 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9044 2.3203 -1.9564 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0233 3.9211 -1.1931 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0702 -3.8725 -1.3342 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4596 -3.1535 -1.5551 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9302 -2.2468 -2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 2 0 0 0 0 2 13 1 0 0 0 0 2 19 1 0 0 0 0 3 14 1 0 0 0 0 3 20 1 0 0 0 0 4 15 1 0 0 0 0 4 18 1 0 0 0 0 5 16 2 0 0 0 0 6 12 1 0 0 0 0 6 17 1 0 0 0 0 6 24 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 12 2 0 0 0 0 9 21 1 0 0 0 0 10 14 1 0 0 0 0 10 22 1 0 0 0 0 11 13 2 0 0 0 0 11 23 1 0 0 0 0 12 16 1 0 0 0 0 13 15 1 0 0 0 0 14 15 2 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 18 28 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 M END $$$$