ASINEX-ZINC04891693 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 0.0190 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -0.4750 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 0.0320 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -0.8850 -3.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -0.3550 -4.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 0.5500 -5.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0360 -6.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 0.6160 -7.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -0.2890 -6.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -0.7780 -5.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8470 -0.7380 -6.4240 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4480 -0.3090 -7.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3860 -1.5360 -5.6770 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 1.1090 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 -0.3420 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 -0.0980 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 -1.5650 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 1.1220 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -0.3190 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -1.8930 -3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -0.9090 -3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 0.8780 -5.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 1.7440 -7.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 0.9970 -7.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -1.4890 -4.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.0110 -2.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 0.0790 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END