D04NGS -OEChem-10191523052D 39 41 0 0 0 0 0 0 0999 V2000 5.8076 3.9188 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6387 -4.5243 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4413 -2.4881 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8076 3.9188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8076 3.9188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4577 -2.8017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8076 -0.0812 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8590 -1.7836 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8371 -1.5757 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0281 -0.1745 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8076 4.9188 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 -0.8131 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8076 0.9188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8076 2.9188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9416 1.4188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6737 1.4188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9416 2.4188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6737 2.4188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9416 -0.5812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 -3.5062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4522 -2.6972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -0.9176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6333 -4.4198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0345 -3.4017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 -5.2288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6223 -4.2107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2156 -5.1242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4047 1.1088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2106 1.1088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3446 -0.3912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4047 2.7288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2106 2.7288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9689 -5.7952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2389 -4.1459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3446 5.2288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2707 5.2288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5800 -5.6258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1122 -0.2467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 11 1 0 0 0 0 1 14 1 0 0 0 0 2 23 1 0 0 0 0 3 24 1 0 0 0 0 6 21 2 0 0 0 0 7 13 1 0 0 0 0 7 19 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 19 2 0 0 0 0 10 19 1 0 0 0 0 10 22 2 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 22 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 17 1 0 0 0 0 15 28 1 0 0 0 0 16 18 2 0 0 0 0 16 29 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 20 21 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 23 25 1 0 0 0 0 24 26 2 0 0 0 0 25 27 2 0 0 0 0 25 33 1 0 0 0 0 26 27 1 0 0 0 0 26 34 1 0 0 0 0 27 37 1 0 0 0 0 M END $$$$