IFLAB-ZINC05240190 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.7990 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0140 0.3280 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -0.4320 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 0.5670 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 0.2370 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4060 -1.0900 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 -2.0960 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 -1.7760 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -2.8480 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -2.6860 0.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -3.8370 0.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -4.7770 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -4.1760 0.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -6.1420 0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -6.6090 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -5.8340 0.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -8.0650 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -8.9570 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -10.3150 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -10.7970 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 -9.9170 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 -8.5510 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4630 -10.4120 -0.1450 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9830 -11.1220 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -11.4180 1.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4090 -11.4970 0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6260 -10.8740 -0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2980 -10.2160 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 -9.6080 -2.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 2.1750 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 2.1930 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 2.1170 1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 1.6040 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7580 1.0170 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4570 -1.3380 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -3.1280 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -6.7600 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -8.5850 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -11.0040 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -11.8610 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 -7.8660 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1010 -11.0670 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5210 -12.5800 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4260 -10.1330 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8460 -11.6470 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 M END