D00KTE -OEChem-10101305022D 43 43 0 1 0 0 0 0 0999 V2000 5.4641 -0.9291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5661 -0.1284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5709 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1013 1.5188 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.9291 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 1.1587 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0981 2.1098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 2.1098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 1.1587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.4291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3582 0.8497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9291 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8660 -0.4291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0524 1.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7955 1.8790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7465 1.5699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4897 2.2391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5041 0.5464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7045 2.2387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0333 2.7264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1629 2.7264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4916 2.2387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2227 1.4109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4791 0.6218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.2391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9724 2.1253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 0.0459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 0.0459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7613 0.6624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5409 0.8281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0866 2.4264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3069 2.2607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.2391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.2391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.3921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.2391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.4660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4555 1.0225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2351 1.1882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9046 1.7783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9504 2.6539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0748 2.6998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 11 2 0 0 0 0 3 6 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 4 27 1 0 0 0 0 12 5 1 1 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 1 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 16 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 17 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 M END $$$$