BH2JN4 -OEChem-04012113552D 39 39 0 1 0 0 0 0 0999 V2000 4.5981 2.9720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.4720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.4720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.0280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.4720 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4720 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8660 -0.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 4.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 2.6060 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 4.5981 -0.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.7820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.5546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -0.1357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6401 3.4350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 4.2820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0201 4.5089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 4.6480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6541 4.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4272 4.0280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4272 2.2960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2741 2.0690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 2.9160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.7820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.2180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.2180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.8380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.8380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.1620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -4.3380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 14 1 0 0 0 0 2 15 1 0 0 0 0 2 38 1 0 0 0 0 3 14 2 0 0 0 0 4 15 2 0 0 0 0 5 20 1 0 0 0 0 5 39 1 0 0 0 0 8 6 1 6 0 0 0 6 14 1 0 0 0 0 6 33 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 16 2 0 0 0 0 10 17 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 17 19 2 0 0 0 0 17 35 1 0 0 0 0 18 20 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 M END $$$$