B4H2QN -OEChem-04022105502D 39 41 0 0 0 0 0 0 0999 V2000 4.6660 -0.4031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4144 2.6315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 1.6210 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.5969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9176 -1.4377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4144 -1.4377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -0.4378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.0969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.0969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4144 -1.4493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4145 -1.4262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 0.0760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4029 -2.4377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 1.6315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.5969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 1.1177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.0969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.0969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.4378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 1.6315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2631 -2.9476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4072 -2.0692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0343 -1.4565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4215 -0.8293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4217 -0.8062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7946 -1.4190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4073 -2.0461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8678 -0.2360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8624 -2.7414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 2.2515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2559 -3.5676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8035 -2.6439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -0.2360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 1.4298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9478 2.9476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7343 1.3131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3843 -1.7539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 18 1 0 0 0 0 2 14 1 0 0 0 0 2 37 1 0 0 0 0 3 16 1 0 0 0 0 3 38 1 0 0 0 0 4 15 2 0 0 0 0 5 19 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 14 1 0 0 0 0 9 15 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 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 16 1 0 0 0 0 12 30 1 0 0 0 0 13 21 2 0 0 0 0 13 31 1 0 0 0 0 14 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 19 22 2 0 0 0 0 20 23 2 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 M END $$$$