B6TBJ1 -OEChem-04012119222D 46 49 0 0 0 0 0 0 0999 V2000 8.6097 2.5133 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 6.8497 2.2346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4188 3.1011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1975 1.7043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0220 3.3224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.6208 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 2.2303 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.4256 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.4256 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.9256 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -0.3297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 1.4256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 -1.0740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 1.4256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 -2.0245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.4256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8497 0.6165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8007 1.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8007 0.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9639 -2.7688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 -2.2307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2746 -3.7193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9209 -3.1813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2531 -3.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3715 -0.8176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5359 -0.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9385 -0.5861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7742 -1.3660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6581 0.0269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3023 0.5611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3572 -2.6410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0243 -1.7693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.6156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 3.7356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8605 -4.1808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5276 -3.3091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4457 -4.5149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 4.4625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 4.2356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 3.3886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9852 2.8490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8141 1.7691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 5 2 0 0 0 0 1 20 1 0 0 0 0 2 16 1 0 0 0 0 2 20 1 0 0 0 0 3 45 1 0 0 0 0 4 46 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 14 1 0 0 0 0 7 12 2 0 0 0 0 7 15 1 0 0 0 0 8 14 2 0 0 0 0 8 24 1 0 0 0 0 9 18 1 0 0 0 0 9 28 1 0 0 0 0 9 38 1 0 0 0 0 10 18 1 0 0 0 0 10 24 2 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 15 18 2 0 0 0 0 16 19 2 0 0 0 0 17 22 2 0 0 0 0 17 23 1 0 0 0 0 19 21 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 21 34 1 0 0 0 0 22 25 1 0 0 0 0 22 35 1 0 0 0 0 23 26 2 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 25 27 2 0 0 0 0 25 39 1 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 M END $$$$