B9NQC4 -OEChem-04042105583D 50 52 0 0 0 0 0 0 0999 V2000 4.4511 -2.3275 -0.4744 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 -2.3425 -0.3632 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4462 0.2745 -0.1021 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4414 0.2635 -0.0214 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3973 1.6123 0.1058 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3922 1.6072 0.1385 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8883 1.6147 0.0881 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8832 1.6052 0.1561 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7143 1.4471 1.3106 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6805 1.4445 1.3271 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6856 1.7750 -1.0827 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7092 1.7726 -1.0664 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7969 0.0194 -0.1076 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7921 0.0166 -0.0847 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3105 -1.2850 -0.2942 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3061 -1.2897 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7301 1.0655 0.0746 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7251 1.0734 0.0215 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6838 -1.5295 -0.2982 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6794 -1.5259 -0.3179 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1034 0.8210 0.0706 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0984 0.8371 -0.0404 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5803 -0.4765 -0.1158 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5756 -0.4625 -0.2102 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0123 -3.0144 0.6955 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0696 -2.9959 0.8468 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2491 2.0411 1.0334 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2367 2.2810 -0.7119 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2440 2.2705 -0.6392 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2313 2.0315 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 1.3164 2.2431 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2008 1.3121 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2059 1.9019 -2.0284 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2518 1.8977 -1.9997 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8112 -0.5005 -0.2574 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8057 -0.5214 -0.1105 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4109 2.0940 0.2215 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4057 2.1034 0.1568 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0627 -2.5375 -0.4437 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0585 -2.5356 -0.4506 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8019 1.6405 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7969 1.6646 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6495 -0.6668 -0.1192 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6449 -0.6464 -0.2584 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 -2.3306 1.3811 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8600 -3.4880 1.2007 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3078 -3.7933 0.3912 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9439 -3.4503 1.3237 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5893 -2.2942 1.5359 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3558 -3.7867 0.6004 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 25 1 0 0 0 0 2 16 1 0 0 0 0 2 26 1 0 0 0 0 3 7 1 0 0 0 0 3 13 1 0 0 0 0 3 35 1 0 0 0 0 4 8 1 0 0 0 0 4 14 1 0 0 0 0 4 36 1 0 0 0 0 5 7 1 0 0 0 0 5 9 2 0 0 0 0 5 11 1 0 0 0 0 6 8 1 0 0 0 0 6 10 2 0 0 0 0 6 12 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 13 15 1 0 0 0 0 13 17 2 0 0 0 0 14 16 1 0 0 0 0 14 18 2 0 0 0 0 15 19 2 0 0 0 0 16 20 2 0 0 0 0 17 21 1 0 0 0 0 17 37 1 0 0 0 0 18 22 1 0 0 0 0 18 38 1 0 0 0 0 19 23 1 0 0 0 0 19 39 1 0 0 0 0 20 24 1 0 0 0 0 20 40 1 0 0 0 0 21 23 2 0 0 0 0 21 41 1 0 0 0 0 22 24 2 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 M END $$$$