B3XW1A -OEChem-04022102003D 45 49 0 0 0 0 0 0 0999 V2000 2.4268 2.5885 -0.0103 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3559 -4.4831 -0.0033 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0338 -0.4704 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9199 0.9509 -0.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7664 -1.5935 -0.0129 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2994 1.7933 -0.0204 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4794 -2.0402 0.0021 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1881 0.3019 -0.0023 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 2.2311 -0.0406 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5588 0.8130 -0.0217 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 2.0734 -0.0128 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3109 -0.7331 -0.0037 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1975 -2.5169 -0.0036 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6446 1.4822 -0.0106 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1015 -3.9603 0.0019 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7691 1.9810 -1.2074 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7278 2.0196 1.2078 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1561 1.8348 -1.1814 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1146 1.8733 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8399 -4.9632 0.0129 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8289 1.7810 0.0393 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7658 2.2158 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1175 -6.1803 0.0144 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2139 -5.8344 0.0045 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4454 2.0238 -1.2033 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 2.0340 1.2125 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7892 1.6498 -1.1932 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7738 1.6601 1.2227 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4533 1.4679 0.0198 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2673 2.7984 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2396 2.8270 0.8234 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5065 0.1201 -0.0348 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2562 2.0197 -2.1648 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1824 2.0886 2.1453 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7122 1.7623 -2.1115 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6385 1.8308 2.1844 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9148 -4.8466 0.0191 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9087 1.6668 0.0597 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5171 -7.1840 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1335 -6.4011 0.0016 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9343 2.1650 -2.1517 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 2.1833 2.1532 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3184 1.5004 -2.1298 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2910 1.5187 2.1671 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4996 1.1767 0.0277 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 22 1 0 0 0 0 2 15 1 0 0 0 0 2 24 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 3 12 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 32 1 0 0 0 0 5 13 2 0 0 0 0 6 10 2 0 0 0 0 6 14 1 0 0 0 0 7 12 2 0 0 0 0 7 13 1 0 0 0 0 8 12 1 0 0 0 0 8 14 2 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 13 15 1 0 0 0 0 15 20 2 0 0 0 0 16 18 1 0 0 0 0 16 33 1 0 0 0 0 17 19 2 0 0 0 0 17 34 1 0 0 0 0 18 21 2 0 0 0 0 18 35 1 0 0 0 0 19 21 1 0 0 0 0 19 36 1 0 0 0 0 20 23 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 25 2 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 25 27 1 0 0 0 0 25 41 1 0 0 0 0 26 28 2 0 0 0 0 26 42 1 0 0 0 0 27 29 2 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 29 45 1 0 0 0 0 M END $$$$