ASINEX-ZINC00678546 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 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 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 -0.7580 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3670 -1.2360 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -1.4830 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -1.2490 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -0.7760 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2820 -1.9530 0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8790 -2.1850 1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3040 -2.7080 1.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.8660 -2.0130 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9850 -2.8380 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3860 -3.2240 2.3050 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8870 -4.5170 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3160 -5.7990 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1150 -5.9290 2.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1110 -6.8840 2.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7200 -7.7700 2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4370 -6.7570 2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1220 -7.7570 1.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.0250 -5.5480 1.9560 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2610 -4.3960 2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5480 -3.0950 2.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4480 -2.3850 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3640 -0.6250 2.1790 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.1140 -0.2260 1.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9140 -0.7100 3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2760 1.2880 1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4730 -5.4510 1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2610 -3.9880 0.4960 O 0 0 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 -0.5650 -2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8810 -1.4170 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8400 -1.4410 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -0.5980 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2910 -2.9220 1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9060 -1.2510 1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4750 -3.5980 3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9390 -1.8820 3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4820 -0.7190 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9680 -0.4700 3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7980 -1.7890 3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5460 -0.2170 4.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7060 1.6340 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3300 1.5290 1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9080 1.7820 2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9010 -6.4520 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9180 -4.9110 2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6790 -4.9170 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7750 -4.6580 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 23 2 0 0 0 0 16 17 2 0 0 0 0 16 18 1 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 30 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 M END