LDC2H5 -OEChem-05022323573D 42 44 0 1 0 0 0 0 0999 V2000 4.6362 -0.8172 -0.9880 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2400 1.2989 1.7655 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.1496 1.8823 1.8983 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.3491 2.5328 0.2126 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.8006 1.3212 -0.6744 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2362 1.7649 -2.5133 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4328 -0.6088 2.7826 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1188 -1.5741 -1.4072 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4520 -1.1485 0.7779 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6618 -4.1972 -0.0582 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6116 0.8835 0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1446 -0.5269 0.7391 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1711 0.9999 0.4923 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3897 -0.7558 1.5659 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 1.3319 -0.8263 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1488 0.7766 1.4149 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5271 1.4401 -1.2226 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 1.2167 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1841 0.8849 1.0187 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2828 -1.2473 -0.5782 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5997 0.1989 -0.5394 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7310 0.2229 0.2762 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2623 -0.9650 -1.2303 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5250 -0.9171 0.4011 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1077 1.4604 1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1876 -2.0811 -0.2896 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0564 -2.1049 -1.1053 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3392 1.9769 -3.3922 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0010 -3.2488 -0.1619 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2273 1.6288 0.3979 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6724 1.1774 1.9771 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4138 -1.2905 1.0287 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6923 1.5127 -1.4971 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3782 0.5159 2.4447 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9629 0.7098 1.7548 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3535 -1.3495 1.1986 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3907 -0.9988 -1.8783 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4088 -0.9061 1.0351 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7818 -3.0040 -1.6519 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9438 2.8359 -3.0817 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9372 1.0676 -3.5172 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9243 2.2206 -4.3759 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 20 1 0 0 0 0 2 25 1 0 0 0 0 3 25 1 0 0 0 0 4 25 1 0 0 0 0 5 18 1 0 0 0 0 5 21 1 0 0 0 0 6 17 1 0 0 0 0 6 28 1 0 0 0 0 7 14 2 0 0 0 0 8 20 2 0 0 0 0 9 14 1 0 0 0 0 9 20 1 0 0 0 0 9 36 1 0 0 0 0 10 29 3 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 14 1 0 0 0 0 12 32 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 15 17 1 0 0 0 0 15 33 1 0 0 0 0 16 19 2 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 35 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 23 27 2 0 0 0 0 23 37 1 0 0 0 0 24 26 2 0 0 0 0 24 38 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 39 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 M END $$$$