IFLAB-ZINC04061002 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.6060 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 0.1600 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -0.4540 -3.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -1.8360 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -2.6120 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -2.0040 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -2.8290 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -2.2960 0.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -4.1730 -0.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -4.9920 0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -6.4730 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -7.2920 1.6770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -7.8010 2.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -8.5060 3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -8.4430 2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 -7.6640 1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 -7.4220 0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4850 -7.9440 1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -8.7090 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 -8.9650 3.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -9.3440 5.0300 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -9.0090 5.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -9.6700 6.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -10.3060 7.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -9.5560 6.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2380 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 0.1460 -3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -2.3080 -4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -3.6900 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -4.5990 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -4.7580 1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -4.7820 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -6.7080 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -6.6840 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -7.6560 2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1560 -6.8280 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3430 -7.7550 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5970 -9.1100 2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6720 -9.5600 4.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -9.4050 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -7.9330 5.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -9.0480 6.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 -9.9820 7.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 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 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 23 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 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END