BY5QP3 -OEChem-04022103372D 49 53 0 1 0 0 0 0 0999 V2000 8.1962 2.5189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.4601 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 0.9739 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 0.4601 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3073 -0.4492 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.9947 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6660 2.4947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.9947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.4947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.9947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.9947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 2.5294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3009 -0.4296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8714 -1.2509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 2.0156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 2.5294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 0.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4455 -2.1556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8680 -1.1674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1923 -0.5294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3244 -1.0261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0564 -1.0327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3205 -2.0261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0525 -2.0327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1846 -2.5294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5273 2.6147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0646 2.9697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2675 2.9697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8196 3.0084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0214 2.9992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2536 -1.3026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 3.1494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.6619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 2.3276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8063 0.3606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4105 1.0524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8845 -1.8915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1813 -2.7165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0064 -2.4197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9197 -1.7852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4858 -1.1157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8162 -0.5496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7886 -0.7140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5945 -0.7248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7824 -2.3340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5883 -2.3448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1822 -3.1494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 5 1 0 0 0 0 2 10 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 3 19 1 0 0 0 0 4 8 2 0 0 0 0 5 13 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 6 28 1 0 0 0 0 7 11 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 16 2 0 0 0 0 12 15 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 14 20 1 0 0 0 0 14 21 1 0 0 0 0 14 33 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 22 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 45 1 0 0 0 0 24 26 2 0 0 0 0 24 46 1 0 0 0 0 25 27 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 M END $$$$