D04BXL -OEChem-10101305022D 42 45 0 0 0 0 0 0 0999 V2000 2.0000 -1.2329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.7671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2329 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 -0.2676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 1.8017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 0.2463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 1.2879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -0.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7224 -1.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8583 -0.7604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7186 -2.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5904 -0.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5826 -2.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4544 -1.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4506 -2.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -1.8155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -1.1253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 0.7420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 0.7420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 0.3497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -0.3406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -2.2079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -2.2079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 1.5771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2169 -0.8875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2169 2.4217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6659 1.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1804 -2.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 -0.1471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5803 -3.3871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9926 -0.9625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9863 -2.5825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 2 9 1 0 0 0 0 2 11 1 0 0 0 0 3 13 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 5 7 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 8 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 10 13 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 14 16 2 0 0 0 0 14 35 1 0 0 0 0 15 17 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 37 1 0 0 0 0 18 20 3 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 21 23 1 0 0 0 0 21 38 1 0 0 0 0 22 24 2 0 0 0 0 22 39 1 0 0 0 0 23 25 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END $$$$