BK5T4F -OEChem-04022106003D 49 50 0 0 0 0 0 0 0999 V2000 -6.2972 2.1717 -0.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2963 -2.1717 -0.2026 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7120 -0.1385 -0.2532 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 0.1397 -0.2531 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0002 0.0017 -1.0911 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2633 -0.0370 -0.2284 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2633 0.0388 -0.2284 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5203 -0.1111 -1.0933 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5204 0.1143 -1.0931 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9192 -0.1846 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9193 0.1867 -1.0657 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1640 -0.2218 -0.2198 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1641 0.2219 -0.2195 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7941 0.9590 0.1735 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7937 -0.9598 0.1719 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6864 -1.4547 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6870 1.4540 0.1734 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9467 0.9065 0.9575 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9463 -0.9091 0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8389 -1.5070 0.9551 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8395 1.5043 0.9576 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4690 -0.3264 1.3483 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4691 0.3230 1.3489 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0284 -0.8798 -1.7432 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0283 0.8845 -1.7415 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2978 0.8578 0.4059 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2232 -0.9058 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2978 -0.8573 0.4042 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2234 0.9063 0.4425 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4785 -1.0151 -1.7127 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5491 0.7561 -1.7644 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4788 1.0196 -1.7108 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -0.7515 -1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7275 0.6942 0.3359 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7271 -0.6939 0.3347 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9634 0.6732 -1.7493 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9061 -1.0752 -1.7083 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9066 1.0785 -1.7066 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9631 -0.6700 -1.7505 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2048 -2.3825 -0.1266 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2059 2.3826 -0.1226 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4480 1.8183 1.2713 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4472 -1.8216 1.2684 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2454 -2.4668 1.2599 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2464 2.4635 1.2639 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3662 -0.3673 1.9589 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3663 0.3625 1.9596 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8641 2.8727 0.1657 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8629 -2.8736 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 48 1 0 0 0 0 2 15 1 0 0 0 0 2 49 1 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 3 34 1 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 8 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 9 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 12 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 13 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 14 1 0 0 0 0 12 16 2 0 0 0 0 13 15 1 0 0 0 0 13 17 2 0 0 0 0 14 18 2 0 0 0 0 15 19 2 0 0 0 0 16 20 1 0 0 0 0 16 40 1 0 0 0 0 17 21 1 0 0 0 0 17 41 1 0 0 0 0 18 22 1 0 0 0 0 18 42 1 0 0 0 0 19 23 1 0 0 0 0 19 43 1 0 0 0 0 20 22 2 0 0 0 0 20 44 1 0 0 0 0 21 23 2 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 M END $$$$