IFLAB-ZINC04939621 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.3800 0.7760 1.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.5410 1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -0.9200 1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 0.0070 0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 1.3520 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 1.7160 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 2.3310 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 2.0120 -0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 0.7030 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 -0.3110 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 -1.6480 -0.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 -2.1530 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 -1.5600 -1.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0970 -3.6420 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5730 -4.0590 -0.4070 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1120 -3.6320 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 -5.6060 -0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6540 -6.0750 -1.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7570 -3.5580 -1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3710 -3.3900 -2.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8940 -3.5130 -2.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9740 -3.9700 -4.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5950 -3.8900 -5.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5650 -2.5500 -6.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2210 -2.0770 -6.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5090 -2.0580 -4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 1.0750 2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 -1.2820 2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 -1.9670 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 2.7450 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 3.3610 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 2.7830 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9290 0.5100 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 -2.3140 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 -3.9190 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 -4.1630 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0650 -4.5100 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0350 -2.7350 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9770 -4.1550 -3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0800 -2.4150 -3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3400 -2.7200 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1640 -4.4850 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9410 -5.0030 -3.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5120 -3.3340 -3.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6430 -4.2040 -5.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0800 -4.5530 -6.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2640 -1.0610 -6.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6820 -2.7010 -6.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0220 -1.3930 -4.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4650 -1.7580 -4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4650 -6.1580 0.7270 O 0 5 0 0 0 0 0 0 0 0 0 0 7.2730 -3.5630 -1.6800 N 0 3 0 0 0 0 0 0 0 0 0 0 6.9770 -4.2930 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8730 -2.6350 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5330 -3.4530 -4.2630 N 0 3 0 0 0 0 0 0 0 0 0 0 11.0050 -4.0840 -4.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 52 1 0 0 0 0 17 18 2 0 0 0 0 17 51 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 55 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 51 -1 M CHG 1 52 1 M CHG 1 55 1 M END