B3V9GD -OEChem-04012114192D 40 42 0 0 0 0 0 0 0999 V2000 4.3211 -2.6666 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 2.3325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 1.7944 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.9718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.6377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.1670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -1.9223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.1670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 1.5882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -2.1285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 -3.0790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 -1.3842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 2.7449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 -3.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6138 -1.5904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 -2.5410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 2.9512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2351 3.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -0.1670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.9770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.6430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -2.1670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -2.1670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3815 1.3330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 -3.5405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4427 -0.7949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2575 3.3646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6643 2.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4492 -3.8746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0279 -1.1290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5311 -2.6688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8418 3.2852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 15 2 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 4 15 1 0 0 0 0 4 19 1 0 0 0 0 4 32 1 0 0 0 0 5 7 2 0 0 0 0 5 10 1 0 0 0 0 6 9 2 0 0 0 0 6 11 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 8 12 2 0 0 0 0 8 14 1 0 0 0 0 9 25 1 0 0 0 0 10 13 2 0 0 0 0 10 26 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 20 1 0 0 0 0 17 33 1 0 0 0 0 18 21 2 0 0 0 0 18 34 1 0 0 0 0 19 23 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 22 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 3 0 0 0 0 24 40 1 0 0 0 0 M END $$$$