BQMC36 -OEChem-04012118352D 41 42 0 1 0 0 0 0 0999 V2000 6.1646 3.6126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7634 4.6307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 4.6307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3503 0.3693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3503 -4.6307 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.0823 -4.6307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 2.9081 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 0.3693 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -4.1307 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0823 1.3693 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8913 1.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5823 2.9081 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2733 1.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1701 3.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 3.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -0.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.6126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -1.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7524 4.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -1.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3503 -1.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -2.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3503 -2.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -3.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6347 1.0878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2013 1.4202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4577 2.2093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3008 3.4606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7069 2.2093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9633 1.4202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6192 0.0593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9352 4.2292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 3.5478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0648 2.9960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 4.0572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1168 4.9232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2508 4.7861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6192 -1.3207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8133 -1.3207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6192 -2.9407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8133 -2.9407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 19 1 0 0 0 0 2 14 2 0 0 0 0 3 15 2 0 0 0 0 4 16 2 0 0 0 0 5 9 1 0 0 0 0 6 9 2 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 15 1 0 0 0 0 10 8 1 6 0 0 0 8 16 1 0 0 0 0 8 31 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 14 1 6 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 22 1 0 0 0 0 20 38 1 0 0 0 0 21 23 2 0 0 0 0 21 39 1 0 0 0 0 22 24 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 M CHG 2 5 -1 9 1 M END $$$$