B2UXL3 -OEChem-04022116093D 41 44 0 0 0 0 0 0 0999 V2000 -0.5377 -0.5185 -0.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7850 1.3707 -0.3818 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3123 -2.7188 -0.3605 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9559 2.3056 -0.8752 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3766 1.2141 1.0781 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8937 1.1162 -0.7783 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4644 3.2106 0.3112 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9426 3.0841 -1.5044 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9111 -0.6528 -0.1092 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8249 0.3879 -0.3456 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1687 0.1959 -0.0445 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5575 -1.3939 -0.2508 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8106 -0.8544 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3904 -1.8553 0.4252 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6671 -0.9948 0.4888 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8811 -1.7312 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7644 1.7041 -0.8517 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6685 -3.1012 0.0226 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7453 -2.0214 0.7184 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0396 0.5715 0.1031 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3771 -3.5401 -0.2206 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7922 -4.0649 0.1632 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6381 2.5305 1.1221 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0569 2.4389 -0.6142 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9392 3.3172 2.1781 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 0.3812 -0.8001 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7474 -2.6922 0.6691 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7193 -1.1212 0.7178 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8835 -1.3558 0.3243 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9009 2.2508 -1.2037 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0909 -2.9620 1.1403 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7679 1.5988 -0.3002 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1468 -4.5970 -0.3125 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9571 -4.2998 1.2194 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5858 -4.9975 -0.3728 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 -3.6526 -0.2545 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3256 3.0417 3.1639 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0865 4.3924 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1358 3.1133 2.1508 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0967 4.0792 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4121 2.5433 -2.2175 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 12 1 0 0 0 0 1 26 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 2 32 1 0 0 0 0 3 12 1 0 0 0 0 3 21 2 0 0 0 0 4 17 2 0 0 0 0 5 20 1 0 0 0 0 5 23 2 0 0 0 0 6 20 2 0 0 0 0 6 24 1 0 0 0 0 7 23 1 0 0 0 0 7 24 2 0 0 0 0 8 24 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 16 1 0 0 0 0 13 20 1 0 0 0 0 14 19 1 0 0 0 0 14 27 1 0 0 0 0 15 19 2 0 0 0 0 15 28 1 0 0 0 0 16 18 2 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 18 21 1 0 0 0 0 18 22 1 0 0 0 0 19 31 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 25 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 M END $$$$