BNO25X -OEChem-04022113123D 46 48 0 1 0 0 0 0 0999 V2000 -4.6309 0.4373 0.1779 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0834 -0.1852 -0.1555 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2742 2.5963 -0.5623 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5975 0.6226 1.9379 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -1.8319 -0.6139 N 0 0 1 0 0 0 0 0 0 0 0 0 -2.6087 -0.3835 -0.9051 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1593 -1.8738 0.8017 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2311 0.2524 0.3476 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9802 -0.7622 1.4673 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 0.0418 -1.0756 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6465 -1.5787 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2975 -0.2266 0.1832 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8349 -2.5089 -0.8612 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0171 1.6640 -0.2865 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9239 0.2612 0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5095 1.7139 -0.4149 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3299 0.2565 0.3411 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3552 0.6794 1.1871 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6254 -0.1704 -0.9536 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6758 0.6757 0.7384 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -0.1741 -1.4023 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9712 0.2489 -0.5564 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3836 0.2452 -1.0358 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1625 -0.1631 -1.8246 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3373 -2.8496 1.2675 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7524 1.2028 0.6136 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9258 -1.1592 1.8555 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4427 -0.3097 2.3076 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6946 -0.4848 -1.9331 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0777 1.1086 -1.3261 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2748 -1.5997 1.8549 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.3812 0.3002 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5275 0.5746 0.8976 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1085 -2.4226 -1.9184 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6683 -2.1285 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7333 -3.5793 -0.6507 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8455 0.9522 -1.1228 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8088 2.6961 -0.7916 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9705 1.5604 0.5639 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1459 1.0153 2.1993 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8589 -0.5082 -1.6452 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4663 1.0058 1.4072 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1643 -0.5105 -2.4125 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8561 -0.7147 -0.8049 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4346 0.4101 -2.1173 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9634 1.0449 -0.5624 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 14 1 0 0 0 0 2 12 1 0 0 0 0 2 15 1 0 0 0 0 3 14 2 0 0 0 0 4 15 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 24 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 40 1 0 0 0 0 19 21 2 0 0 0 0 19 41 1 0 0 0 0 20 22 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 M END $$$$