B91ESQ -OEChem-04022102312D 35 38 0 0 0 0 0 0 0999 V2000 10.9898 0.6088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7974 -1.2651 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7436 -2.5698 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0653 -2.2651 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6166 -0.4287 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1166 0.4373 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6326 2.3036 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7436 -0.9604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7974 -2.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0542 -0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9313 -0.7651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0653 -1.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3272 -1.7651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0327 0.1964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9313 -2.7651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1993 -0.7651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3864 0.7345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3434 1.1469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6971 1.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6756 1.8912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2857 -1.1718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0948 0.2294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3219 1.3531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9313 -0.1451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9472 -1.7651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4468 -0.2651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9313 -3.3851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7797 0.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2830 2.1464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8682 2.4805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1568 -1.7783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5555 0.6443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2392 2.4315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2185 2.7651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 2 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 2 11 1 0 0 0 0 3 9 2 0 0 0 0 3 13 1 0 0 0 0 4 12 1 0 0 0 0 4 15 2 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 33 1 0 0 0 0 6 22 2 0 0 0 0 7 23 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 10 1 0 0 0 0 8 13 2 0 0 0 0 9 15 1 0 0 0 0 10 14 2 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 16 1 0 0 0 0 13 25 1 0 0 0 0 14 18 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 16 21 2 0 0 0 0 16 22 1 0 0 0 0 17 19 2 0 0 0 0 17 28 1 0 0 0 0 18 20 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 21 31 1 0 0 0 0 22 32 1 0 0 0 0 M END $$$$