BV4M7B -OEChem-04022111493D 55 57 0 1 0 0 0 0 0999 V2000 5.8397 -1.9900 -0.9769 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4958 0.2524 -0.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7925 0.5541 2.2151 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4853 -3.8421 -1.0567 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3835 -0.7034 0.9133 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0133 -0.7082 -0.3125 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8801 -0.0566 0.2565 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 1.2931 0.6909 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7582 -0.5946 -1.1403 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8802 -0.9129 0.8543 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9546 1.3960 0.1010 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4213 2.8515 -0.0265 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4992 3.7547 -0.8708 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4173 -2.3548 0.8598 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1421 -1.0023 0.0167 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9115 0.6111 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8799 -2.8362 -0.4879 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3972 3.2011 -2.2948 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9854 5.2039 -0.9157 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2222 0.2400 0.4315 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5272 0.3858 1.1846 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7367 -0.4651 0.9625 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5577 -0.6652 -0.1604 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9435 -0.4133 -0.0837 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2816 -0.0165 2.1622 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0356 -1.1161 -1.3803 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4616 0.0348 1.1284 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6457 0.2336 2.2449 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8725 -1.3038 -2.4708 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2145 -1.0311 -2.2995 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0880 -0.5396 1.8624 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9242 0.9144 -0.8826 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 2.8688 -0.4468 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5078 3.2896 0.9775 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4949 3.7597 -0.4297 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3334 -2.4572 0.9572 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9309 -2.9404 1.6286 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9839 -1.3720 0.6155 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8725 0.0215 -0.7565 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3746 1.9913 1.3781 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3869 3.0701 -2.7454 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8265 3.8842 -2.9339 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8762 2.2394 -2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9794 5.2745 -1.3701 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2999 5.8293 -1.4972 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0448 5.6218 0.0948 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4438 0.2162 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3072 0.4140 2.2578 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9841 1.3376 0.8836 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6596 0.1333 3.0401 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9752 -1.3262 -1.4979 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5272 0.2376 1.2192 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0798 0.5819 3.1776 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4858 -1.6518 -3.4214 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9165 -1.1594 -3.1168 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 17 1 0 0 0 0 2 15 1 0 0 0 0 2 47 1 0 0 0 0 3 16 2 0 0 0 0 4 17 2 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 20 2 0 0 0 0 7 10 1 0 0 0 0 7 16 1 0 0 0 0 7 39 1 0 0 0 0 8 11 1 0 0 0 0 8 20 1 0 0 0 0 8 40 1 0 0 0 0 9 24 1 0 0 0 0 9 30 2 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 13 35 1 0 0 0 0 14 17 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 25 2 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 27 1 0 0 0 0 25 28 1 0 0 0 0 25 50 1 0 0 0 0 26 29 2 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 M END $$$$