IFLAB-ZINC04583160 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 3.4100 1.6660 2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 0.2450 2.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 -0.4920 2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 0.1400 2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -0.6050 1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -1.9830 1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 -2.6270 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -1.8740 2.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -4.1030 2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -4.7740 1.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -4.7050 3.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -6.1660 3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 -6.6810 4.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -5.9530 5.6410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 -4.5210 5.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -3.9170 4.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 -6.5030 6.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 -5.9550 8.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 -6.5350 9.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -7.6320 9.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -8.0830 8.1950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -7.5410 7.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 -8.2500 10.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -7.7500 11.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 -8.5860 12.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -9.7080 13.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -10.4750 14.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -10.1210 15.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -8.9990 14.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -8.2290 13.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 2.0100 3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 2.1320 2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 1.9370 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 1.2180 1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -0.1080 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -2.5620 1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4050 -2.3670 2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -6.6190 2.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 -6.4180 3.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -6.5200 4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 -7.7460 4.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -4.3900 5.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 -4.0190 6.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 -3.9570 4.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -2.8820 4.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -5.1050 7.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -6.1520 10.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -9.0120 10.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 -7.8090 11.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -6.7120 11.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -9.9840 12.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -11.3520 14.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -10.7210 15.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 -8.7230 15.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -7.3510 13.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 M END