BO3E4T -OEChem-04042103223D 42 44 0 1 0 0 0 0 0999 V2000 -1.4692 -0.2636 1.0123 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3124 2.8265 0.7229 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1023 2.0644 -1.1931 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6047 -0.4426 -0.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7851 -0.1930 0.1323 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6311 1.0149 1.1057 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7998 0.1090 0.4707 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0307 -1.7814 -0.9692 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9144 1.7577 -0.1503 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1437 1.1131 -0.7765 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6476 0.2278 0.3514 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3517 0.6150 0.7190 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4914 -0.9424 -0.1246 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0257 2.3855 -1.1709 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0082 -1.7738 1.0535 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1193 0.0342 0.3418 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6298 -1.2734 -0.6981 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8338 -0.9218 -0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 -1.7450 -1.0257 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8952 -2.9278 0.6052 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2236 -0.8561 -0.2827 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9789 0.9728 1.1095 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8565 0.5003 -1.6402 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2209 0.8310 1.0682 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.9742 1.6843 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9087 -1.5903 -0.7895 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9184 2.7920 -0.6828 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4558 3.2286 -1.6793 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3437 1.6684 -1.9339 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1673 -2.1764 1.6297 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5957 -1.1402 1.7293 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5142 3.1634 1.1649 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6954 2.6097 -1.8872 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3497 -1.6209 -0.9956 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1259 0.1258 -0.2705 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0827 -2.5909 -1.6691 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3577 -3.5906 -0.0804 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2095 -3.5190 1.4713 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7975 -2.5678 0.1013 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4716 1.7340 1.7047 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6147 -2.5077 -1.5359 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0360 -1.7108 -0.8885 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 9 1 0 0 0 0 2 32 1 0 0 0 0 3 10 1 0 0 0 0 3 33 1 0 0 0 0 4 13 1 0 0 0 0 4 35 1 0 0 0 0 5 12 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 16 2 0 0 0 0 6 22 1 0 0 0 0 7 21 1 0 0 0 0 7 22 2 0 0 0 0 8 21 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 12 25 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 20 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 18 1 0 0 0 0 17 19 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 21 2 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 22 40 1 0 0 0 0 M END $$$$