BK9D3F -OEChem-04012116482D 42 45 0 0 0 0 0 0 0999 V2000 9.6680 1.2912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6186 0.0345 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4131 -2.0803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3943 0.1174 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1186 -1.5043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8095 -0.5533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7941 -0.3210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1186 -1.5043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4276 -0.5533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4336 -2.2890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0912 -1.0897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4430 -0.3210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8035 -2.2890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7410 0.6336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1459 -1.0897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8240 -2.0803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7167 0.8528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0633 1.3689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0147 1.8073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3613 2.3235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3370 2.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3700 0.3366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0477 -0.3987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0338 0.2508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2718 0.0129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2072 -2.8663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9636 -2.6108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -0.5992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -1.3794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6186 0.6545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6051 -2.8764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7519 -0.9585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2371 -2.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4584 1.2330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6196 1.9432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9411 2.7794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2096 -0.4744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5217 3.1345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5918 -0.8189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4679 -0.8547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5036 0.0214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 2 0 0 0 0 2 6 1 0 0 0 0 2 9 1 0 0 0 0 2 30 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 3 31 1 0 0 0 0 4 17 1 0 0 0 0 4 22 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 11 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 12 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 14 1 0 0 0 0 12 15 2 0 0 0 0 13 16 2 0 0 0 0 13 32 1 0 0 0 0 14 17 1 0 0 0 0 14 18 2 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 17 19 2 0 0 0 0 18 20 1 0 0 0 0 18 35 1 0 0 0 0 19 21 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M END $$$$