B7NTI8 -OEChem-04022102502D 32 34 0 0 0 0 0 0 0999 V2000 4.7690 0.6928 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1702 1.7109 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.8082 5.1560 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.8460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.8460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1812 1.5018 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -0.2582 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.8460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.8460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 0.6928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5879 2.4154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.3460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.3460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0780 -0.2582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.3460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.3460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.8460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5825 2.5199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0002 3.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9892 3.4335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4069 4.1380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4014 4.2425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -2.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5646 1.4370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6677 -0.4498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -3.6560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3836 3.1596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6058 3.4983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0425 4.6395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.5360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -5.1560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 14 1 0 0 0 0 2 18 1 0 0 0 0 3 22 1 0 0 0 0 4 15 1 0 0 0 0 4 31 1 0 0 0 0 5 17 1 0 0 0 0 5 32 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 25 1 0 0 0 0 7 9 1 0 0 0 0 7 10 2 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 14 2 0 0 0 0 11 18 2 0 0 0 0 11 19 1 0 0 0 0 12 15 1 0 0 0 0 12 23 1 0 0 0 0 13 16 2 0 0 0 0 13 24 1 0 0 0 0 14 26 1 0 0 0 0 15 17 2 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 18 20 1 0 0 0 0 19 21 2 0 0 0 0 19 28 1 0 0 0 0 20 22 2 0 0 0 0 20 29 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 M END $$$$