ASINEX-ZINC04454278 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.5360 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 0.0060 0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5150 -0.3330 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -0.5050 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -0.9060 2.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -0.5170 1.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7530 -0.8800 2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -0.7260 3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -1.0860 4.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0950 -1.6030 4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 -1.7630 3.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 -1.4090 2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 -1.5840 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 -1.1870 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 -2.1840 0.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -0.6250 0.0090 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.0180 -1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5300 -0.2920 -1.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 -0.8100 -1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9990 0.1550 -3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 -0.0800 -3.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 0.9350 -3.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4680 1.4400 -5.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 2.1610 -5.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 2.3940 -5.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 1.9110 -4.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 1.1700 -3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 0.6800 -2.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 1.9160 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 1.9060 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.8760 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -0.2730 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -0.3230 3.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -0.9630 5.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6110 -1.8820 5.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7180 -2.1670 3.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3470 -2.5010 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3450 -2.2990 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4660 1.2640 -5.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 2.5530 -6.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 2.9650 -6.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 2.1000 -3.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 28 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 M END