IFLAB-ZINC02708403 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.8460 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -2.5740 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -2.4240 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -2.7460 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7950 -3.2630 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0880 -3.3720 -0.7380 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 -2.7090 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 -2.4910 -2.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -2.8080 -3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -3.2840 -3.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -2.5700 -4.8670 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0840 -1.5260 -4.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -3.4700 -5.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -3.4340 -6.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -3.7920 -6.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -3.7630 -8.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -3.3770 -9.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -3.0150 -8.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 -3.0410 -7.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -2.6470 -7.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 -2.1370 -7.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 -2.8810 -5.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7740 -3.6930 2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0200 -3.8340 3.3900 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3560 -4.6980 3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1950 -2.5670 3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0360 -2.5230 2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0210 -4.0220 4.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -2.1100 -2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -3.1240 -4.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -4.4930 -4.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -4.0950 -6.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -4.0440 -8.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -3.3580 -10.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 -2.7130 -9.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5570 -2.9410 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2180 -4.6510 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 -1.6890 3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 -2.5780 4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -3.3080 2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -1.5500 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6120 -4.9200 4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4830 -4.1220 5.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6820 -3.1570 4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 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 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 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 40 1 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 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 31 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END