IFLAB-ZINC04568858 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -0.8380 3.3750 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 2.3230 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 2.2230 2.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 4.5280 2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 4.6280 1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 3.4760 4.8690 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0520 2.7170 5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 4.8350 5.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 5.2420 5.4460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 6.4140 5.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 7.1320 6.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 6.8320 5.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 8.1910 6.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 8.6150 6.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 8.7210 4.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 7.3620 4.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 6.9370 4.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 3.1150 4.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4790 1.8660 5.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8200 1.5300 5.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 2.4450 4.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3560 3.7020 4.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 4.0340 4.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4600 4.4100 4.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5780 3.7260 4.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1220 2.3650 4.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 2.3970 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 3.6690 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 4.1090 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 2.6400 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 1.3490 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 1.8800 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 1.5160 3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 5.5010 3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9250 4.2110 2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 5.3340 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 4.9710 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 5.5760 5.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 4.7600 6.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 4.6670 4.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 6.0910 6.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 8.9320 6.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 8.1160 7.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 9.5840 6.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 7.8740 6.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2460 9.4620 4.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 9.0230 4.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 7.4370 3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 6.6200 4.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 5.9690 3.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 7.6790 3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 1.1520 5.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1320 0.5550 5.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 5.0100 4.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8040 4.1420 5.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4520 3.7810 3.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 3.3050 0.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 3.5460 3.4870 N 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 57 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 57 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 58 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 58 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 57 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 6 58 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 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 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 M END