B3KZN1 -OEChem-04022108263D 38 40 0 0 0 0 0 0 0999 V2000 -5.5517 -0.6415 -0.0321 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6181 2.8180 -2.6611 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7833 0.5828 -2.2829 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1368 -4.3724 -0.1584 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 0.0065 0.3571 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6595 1.3182 0.5962 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4709 -0.1650 0.2533 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7805 -1.0807 0.2289 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0308 2.1184 -0.4651 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8779 1.6916 1.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0685 -0.0558 -0.9846 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1915 -0.4280 1.3994 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2271 -0.9614 0.3232 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -2.3859 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6458 3.3432 -0.2051 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4931 2.9163 2.1679 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8772 3.7419 1.1114 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4506 -0.2171 -1.0811 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5738 -0.5893 1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0174 -2.0354 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -3.4798 -0.1358 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2034 -0.4840 0.0627 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8065 1.7391 -1.8552 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4263 -3.3797 -0.0416 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5848 1.0584 2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5165 0.1380 -1.8944 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -0.5129 2.3705 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7257 -0.0151 0.4953 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8873 -2.5328 -0.0861 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9704 4.0041 -1.0046 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6742 3.2265 3.1929 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3592 4.6938 1.3142 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9290 -0.1353 -2.0535 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1546 -0.7972 2.1975 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0963 -1.9588 0.2661 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5112 -4.4576 -0.3112 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8168 -0.5362 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4666 2.5548 -3.5939 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 37 1 0 0 0 0 2 23 1 0 0 0 0 2 38 1 0 0 0 0 3 23 2 0 0 0 0 4 24 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 2 0 0 0 0 6 9 1 0 0 0 0 6 10 2 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 9 15 2 0 0 0 0 9 23 1 0 0 0 0 10 16 1 0 0 0 0 10 25 1 0 0 0 0 11 18 1 0 0 0 0 11 26 1 0 0 0 0 12 19 2 0 0 0 0 12 27 1 0 0 0 0 13 20 2 0 0 0 0 13 28 1 0 0 0 0 14 21 2 0 0 0 0 14 29 1 0 0 0 0 15 17 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 18 22 2 0 0 0 0 18 33 1 0 0 0 0 19 22 1 0 0 0 0 19 34 1 0 0 0 0 20 24 1 0 0 0 0 20 35 1 0 0 0 0 21 24 1 0 0 0 0 21 36 1 0 0 0 0 M END $$$$