IFLAB-ZINC04062851 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -1.4960 2.5040 -1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 1.0020 -1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -0.9730 -1.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -1.5380 -2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -0.1800 -4.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 0.4230 -3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -2.3110 -5.0610 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9040 -3.2870 -4.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -2.6780 -6.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 -3.0940 -6.1940 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -3.7200 -7.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 -4.0430 -8.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -4.0060 -6.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -3.6120 -5.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2090 -4.7030 -7.5730 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5750 -5.0830 -7.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1220 -5.9150 -8.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8970 -7.2930 -8.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3820 -8.0280 -9.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0740 -7.3540 -10.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3050 -6.0230 -10.5410 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8230 -5.3370 -9.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 -1.7310 -5.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 -0.7330 -6.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 -0.2570 -6.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7610 -0.7910 -5.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4990 -1.7460 -4.4850 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -2.1920 -4.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 2.9950 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 2.7650 -2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 2.9180 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 0.7840 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 0.4880 -1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -1.5960 -1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -0.8920 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -0.9520 -2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -2.5610 -2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -0.1860 -5.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 0.4790 -4.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 1.4600 -4.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 -0.1540 -3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -1.8350 -7.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -3.4910 -6.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -2.8870 -5.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 -4.9490 -8.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -5.6310 -6.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1660 -4.1700 -7.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3390 -7.7960 -7.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 -9.0980 -9.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4700 -7.8810 -11.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0200 -4.2680 -9.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 -0.3120 -6.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0700 0.5110 -6.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7930 -0.4550 -5.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 -2.9670 -3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 0.4250 -2.3640 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5430 1.0140 -2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -1.5380 -4.1950 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 56 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 58 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 58 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 6 56 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 7 58 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 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 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 2 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 28 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END