D00SHX -OEChem-10101305022D 39 40 0 0 0 0 0 0 0999 V2000 4.5981 1.9806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 2.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 2.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 3.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 3.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.9806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2227 2.8205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4791 2.0314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7171 2.0314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9735 2.8205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1629 4.1360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7045 3.6483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0333 4.1360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4916 3.6483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 0.3980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 1.0882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 1.0632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 0.3729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.0175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.0564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 -1.0564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 0.0175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -3.5194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.1394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 -3.5194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 6 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 5 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 24 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 10 12 2 0 0 0 0 10 15 1 0 0 0 0 11 13 2 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 16 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 M END $$$$