D0D8MD -OEChem-10101305022D 56 59 0 0 0 0 0 0 0999 V2000 9.8506 3.0171 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.5903 1.0238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6009 -1.7044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 0.0104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5171 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 0.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5942 0.0276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0975 -0.8442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 0.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0975 -0.8365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6009 -1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 0.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7224 1.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 0.5138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4544 1.5271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8544 2.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9904 1.5138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 0.5071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 0.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.0379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 -1.5517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1760 0.2419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4842 0.6378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6211 -0.4475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6241 -1.2445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5740 -1.2332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5709 -0.4361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0191 -1.9226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7109 -2.3184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8646 -0.6029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2581 1.8325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7665 0.9914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 1.8392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1424 2.0628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4522 1.8217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6589 0.9836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8618 0.9805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4848 1.1376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9338 -1.3500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4848 -2.1717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -3.0997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -2.4094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.1029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.2929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -2.4801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.3271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -3.5540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 7 1 0 0 0 0 2 16 1 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 4 15 1 0 0 0 0 4 19 1 0 0 0 0 5 28 2 0 0 0 0 6 21 1 0 0 0 0 6 26 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 8 11 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 12 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 15 1 0 0 0 0 13 39 1 0 0 0 0 14 17 2 0 0 0 0 14 40 1 0 0 0 0 15 18 2 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 30 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 29 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 M END $$$$