D00TGC -OEChem-10191522302D 42 43 0 0 0 0 0 0 0999 V2000 7.1962 -0.4720 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.4720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.4720 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.0280 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.5280 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -1.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -2.8380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.5280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.9350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.7820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8291 -3.1480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -3.3750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -2.5280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -0.7960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -0.5690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8291 -1.4160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -3.0089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.1620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.7820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 0.5030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 0.5030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3082 -1.4720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.0920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5482 -1.4720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 1.3380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.8380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 2.8380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 18 2 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 17 2 0 0 0 0 4 20 1 0 0 0 0 5 20 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 8 30 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 14 1 0 0 0 0 11 31 1 0 0 0 0 12 15 2 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 18 21 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 21 40 1 0 0 0 0 M END $$$$