B8EO1C -OEChem-04012113052D 40 41 0 1 0 0 0 0 0999 V2000 5.4641 -0.0194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 2.0684 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.7320 -0.0194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4806 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7891 2.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 3.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 3.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3582 1.7594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1505 1.1991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2227 2.3205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4791 1.5314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1629 3.6360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4916 3.1483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7045 3.1483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0333 3.6360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1666 1.1697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9478 1.5678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5497 2.3490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 1.0175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.7906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -0.0564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.8294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.8294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 -1.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.7094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 -0.4825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.4825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.7094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 2 9 1 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 6 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 13 15 2 0 0 0 0 13 17 1 0 0 0 0 14 18 2 0 0 0 0 14 32 1 0 0 0 0 15 18 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 M END $$$$