BS3P2Z -OEChem-04012116102D 25 26 0 0 0 0 0 0 0999 V2000 2.8090 3.5546 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8913 1.3113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5778 -2.0546 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4901 0.2932 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0778 -0.5158 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 2.0158 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5778 -3.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7688 -1.4668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0778 -0.5158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3869 -1.4668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4439 -3.5546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8968 1.2068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 2.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 2.9668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9673 -2.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3658 -3.6372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -1.6584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9765 -1.6584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1339 -4.0916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9808 -3.8646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7539 -3.0177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8735 0.2284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2077 3.1584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4103 3.1584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 12 2 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 4 23 1 0 0 0 0 5 9 1 0 0 0 0 5 10 2 0 0 0 0 6 13 1 0 0 0 0 6 15 2 0 0 0 0 7 11 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 10 19 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 M END $$$$