B2XKR6 -OEChem-04022108363D 36 38 0 1 0 0 0 0 0999 V2000 -1.6349 0.8148 -0.2135 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8294 -0.0473 0.7284 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0511 0.2414 -1.8703 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4238 1.0595 0.0727 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9790 -1.1498 0.3382 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6107 -1.5564 -0.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0824 0.2551 -0.4593 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7648 -0.3568 -1.6778 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3156 -0.2831 -0.2576 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1743 0.1528 0.5559 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7641 0.3039 -0.7015 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9765 -1.6834 0.0541 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6988 -0.5090 0.0255 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9616 0.1954 1.7068 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1349 0.5414 -0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 -3.0415 0.2402 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3344 0.4188 1.6003 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9193 0.5968 0.3462 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0991 -0.2811 0.1599 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8063 1.4129 0.1944 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9439 2.9155 0.0714 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0599 1.3497 -0.5591 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8976 -1.4420 -1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1776 -0.1771 -2.5851 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5128 0.0670 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6001 0.6728 -1.7792 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2378 -3.2842 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7344 -3.7954 0.2212 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0421 -3.1224 1.2031 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9484 0.4587 2.4955 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9879 0.7748 0.2668 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3780 0.9209 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1804 1.0839 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9901 3.2211 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3606 3.4205 0.8484 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5548 3.2602 -0.8923 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 2 7 1 0 0 0 0 2 10 1 0 0 0 0 3 8 1 0 0 0 0 3 11 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 19 2 0 0 0 0 6 9 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 19 1 0 0 0 0 14 17 1 0 0 0 0 14 25 1 0 0 0 0 15 18 1 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 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 M END $$$$