B13HLB -OEChem-04022110493D 43 44 0 0 0 0 0 0 0999 V2000 -2.8814 -1.9947 -0.1517 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6436 0.0198 -1.6426 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2638 0.1590 0.6848 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3089 -0.5898 0.2508 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3722 0.1228 -0.5798 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5455 1.3798 -1.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5019 0.3655 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -0.0336 0.5739 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0653 0.1671 -0.4873 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3627 -0.7201 -0.1907 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2480 0.7881 -0.1018 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0142 1.6624 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7356 -0.5087 -0.0645 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3873 1.8738 -0.2652 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8744 0.3441 2.0109 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6921 -0.7959 -0.4713 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0264 0.5437 1.5115 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0704 -0.9806 -0.5788 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4048 0.3587 1.4041 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9269 -0.4036 0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7159 1.0144 0.0327 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8348 -3.0415 0.0185 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0114 0.2695 -0.4485 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3533 2.5161 -0.5175 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4565 -1.3093 0.0632 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7724 2.8894 -0.2974 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9013 -0.0222 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8701 1.4126 2.2464 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3063 -0.2085 2.7658 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0741 -1.3315 -1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6502 1.1550 2.3268 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4674 -1.5901 -1.3866 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0644 0.8148 2.1378 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2253 0.7422 -0.8972 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1257 0.4142 0.8521 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9449 2.0623 0.2544 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -3.9844 0.0271 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5325 -3.0943 -0.8243 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3476 -2.9687 0.9836 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8604 -0.6501 -0.1405 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9269 0.7798 -1.1173 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 1.6345 -1.1244 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1777 1.9834 -1.6337 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 22 1 0 0 0 0 2 9 2 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 15 1 0 0 0 0 4 20 1 0 0 0 0 4 23 2 0 0 0 0 5 23 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 23 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 9 1 0 0 0 0 7 10 2 0 0 0 0 7 12 1 0 0 0 0 8 16 2 0 0 0 0 8 17 1 0 0 0 0 10 13 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 11 21 1 0 0 0 0 12 14 2 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 18 1 0 0 0 0 16 30 1 0 0 0 0 17 19 2 0 0 0 0 17 31 1 0 0 0 0 18 20 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END $$$$