BS2QU3 -OEChem-04012116122D 33 35 0 0 0 0 0 0 0999 V2000 2.4586 -0.3941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3500 1.2614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9487 2.2795 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9705 2.4874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0767 -0.3941 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 3.1455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7796 3.8887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3554 1.3659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7676 0.5569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4432 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2676 -0.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2676 -1.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7676 0.5569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4016 -2.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1337 -2.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4016 -3.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1337 -3.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2676 -3.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9085 4.4951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 2.6334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0598 3.3148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3784 3.8666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 4.5188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 4.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 3.4450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4032 1.0585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8647 -2.1719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6706 -2.1719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8647 -3.7919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6706 -3.7919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2676 -4.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 15 1 0 0 0 0 2 9 2 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 9 1 0 0 0 0 4 8 2 0 0 0 0 5 10 1 0 0 0 0 5 12 2 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 10 15 2 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 17 19 2 0 0 0 0 17 30 1 0 0 0 0 18 20 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 M END $$$$