IFLAB-ZINC04387855 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 66 0 0 1 0 0 0 0 0999 V2000 0.1800 1.9280 -0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 0.4700 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -0.3740 0.2330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -0.4810 1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -1.6370 1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -1.0790 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -1.8230 1.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 -0.9460 -1.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1880 0.0620 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -2.0150 -2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 -3.0920 -2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -2.7580 -1.2470 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4600 -3.1330 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 -1.2220 -1.1620 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6650 -0.7300 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7370 -1.7280 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 -2.5200 -0.5720 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6870 -1.7820 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 -3.4190 -1.2510 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1680 -4.3250 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8430 -3.8960 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1110 -4.7160 -2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1500 -4.0280 -1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3440 -4.1650 -1.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6770 -3.3110 -0.2330 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4510 -4.4020 0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8180 -2.3830 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1370 -1.1540 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3610 -0.3420 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9070 -0.6840 0.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 -0.5240 -2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 2.0460 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 2.5300 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 2.3350 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 0.3780 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.1070 -1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -0.6280 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 0.4630 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -1.5090 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -2.5900 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -1.7000 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -2.4680 -1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -1.5630 -3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -4.0990 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 -3.0360 -3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1650 0.2210 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 -0.4940 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4860 -1.1640 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 -2.4230 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1090 -4.5250 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0530 -3.0410 -3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8710 -5.6770 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5610 -4.9290 -3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7460 -5.1730 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3900 -4.9240 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0800 -3.9750 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5670 -2.0430 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7360 -2.9760 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3040 -1.4550 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2890 -0.4600 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 0.5640 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 -0.7090 -2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 -0.8290 -3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6630 0.6030 -0.8990 O 0 5 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 6 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 31 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 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 30 2 0 0 0 0 29 64 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 M CHG 1 64 -1 M END