IFLAB-ZINC02722358 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 0 0 0 0 0 0999 V2000 1.5100 1.7830 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 0.3010 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -0.4780 1.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -1.8250 1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 -2.6400 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -4.0090 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -4.5690 1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -3.7520 1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -2.3840 1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -5.9570 1.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -6.7810 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -6.1360 -0.4760 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -8.1140 1.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -9.0090 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -9.4170 -0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -10.3380 -1.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -9.9760 -3.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -11.0850 -3.6690 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -11.0750 -4.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -12.2180 -2.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -11.8000 -1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -12.7460 -0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -14.0750 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -14.4920 -2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -13.5750 -3.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -8.5570 -3.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -8.6660 2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -8.7620 3.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -9.9070 3.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -9.9580 4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -8.9350 5.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -7.8300 5.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -7.7080 4.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 2.0860 1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 2.3760 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 1.9410 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -0.0030 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 0.1430 2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -2.2040 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -4.6430 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -4.1870 2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7500 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -6.3250 2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -9.8990 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -8.4960 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -8.5270 -1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -9.9300 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -12.4280 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -14.8060 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -15.5460 -2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 -13.9100 -4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -8.2820 -4.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 -8.4750 -4.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -7.8870 -2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -9.6590 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -8.0150 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -10.7480 2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -10.8460 4.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -7.0120 6.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -6.8030 4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 33 60 1 0 0 0 0 M END