BS9V8A -OEChem-04022115393D 40 42 0 0 0 0 0 0 0999 V2000 -3.0958 0.6759 -0.7895 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1222 -0.3116 0.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4374 0.4612 1.0598 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8239 -2.4411 -0.6328 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3436 0.1759 0.5798 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6013 0.8259 -1.7265 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6546 0.4062 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1487 0.4594 -0.2917 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0333 -0.6058 0.4048 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7549 -0.4098 0.5884 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5271 -0.5585 0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3335 -1.5937 -0.1729 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1458 -1.5599 -0.1182 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9346 0.5042 1.1185 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7533 1.5122 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9331 -0.5440 -0.8606 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1425 1.5617 0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3220 -0.4947 -0.7426 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9268 0.5582 -0.0559 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8751 0.5450 -0.6276 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6871 0.0869 0.6662 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5420 0.3483 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2491 -0.3190 1.9872 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9370 0.7172 -1.5692 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2519 1.4279 -0.4465 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3839 -0.0764 -1.3681 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8822 -0.3106 1.4054 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9503 -1.5335 0.1321 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -2.4237 -0.6838 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2696 1.3811 1.6544 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1529 2.2987 0.8444 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4735 -1.3705 -1.3961 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6133 2.3811 1.0482 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9328 -1.2762 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0083 0.5965 0.0361 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6182 0.2719 -0.2975 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9018 0.4665 2.3811 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4515 -0.4927 2.7172 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8234 -1.2456 1.8884 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5274 0.9423 -2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 20 1 0 0 0 0 2 7 1 0 0 0 0 2 10 1 0 0 0 0 3 9 1 0 0 0 0 3 14 1 0 0 0 0 4 13 2 0 0 0 0 5 20 1 0 0 0 0 5 21 2 0 0 0 0 6 20 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 15 2 0 0 0 0 8 16 1 0 0 0 0 9 11 1 0 0 0 0 9 12 2 0 0 0 0 10 13 1 0 0 0 0 10 14 2 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 14 30 1 0 0 0 0 15 17 1 0 0 0 0 15 31 1 0 0 0 0 16 18 2 0 0 0 0 16 32 1 0 0 0 0 17 19 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 2 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 M END $$$$