B5N7BQ -OEChem-04022105103D 38 41 0 0 0 0 0 0 0999 V2000 4.1127 2.5228 -0.0362 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1385 -0.0189 1.0028 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2779 1.1458 -0.5798 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8284 -1.1091 1.8675 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7998 -0.5683 -0.2113 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9469 -0.5555 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9987 0.0240 -0.2264 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4265 -1.0713 -0.6611 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4635 0.3478 1.0206 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5901 -1.0652 0.1934 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8661 -1.0715 -2.3156 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4813 -1.5768 -1.9627 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3602 0.3029 -0.4692 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6468 -1.5780 -2.7795 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2209 0.9369 2.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4668 0.0139 0.2154 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1302 0.8924 0.5396 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5669 1.2036 1.7748 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8315 -2.1665 1.0072 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5613 -0.0567 1.0619 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9541 -2.1392 1.8189 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0787 2.2926 -0.6549 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5292 3.2941 -1.6397 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5023 0.1006 1.7789 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7372 -1.0792 -2.9648 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4129 -1.9781 -2.3571 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 0.0657 -1.4274 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5812 -1.9760 -3.7886 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7828 1.1799 3.0018 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1792 1.1087 0.3558 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1823 1.6609 2.5453 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -3.0285 1.0198 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3094 0.7147 1.1675 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4561 1.1375 -1.1787 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -2.9731 2.4729 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5056 3.5637 -1.3644 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1463 4.1968 -1.6339 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5361 2.8638 -2.6451 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 2 0 0 0 0 2 5 1 0 0 0 0 2 9 1 0 0 0 0 2 24 1 0 0 0 0 3 16 1 0 0 0 0 3 22 1 0 0 0 0 3 34 1 0 0 0 0 4 20 2 0 0 0 0 4 21 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 9 1 0 0 0 0 7 13 2 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 9 15 2 0 0 0 0 10 16 2 0 0 0 0 10 19 1 0 0 0 0 11 14 2 0 0 0 0 11 25 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 13 17 1 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 15 18 1 0 0 0 0 15 29 1 0 0 0 0 16 20 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 19 21 2 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 M END $$$$