IFLAB-ZINC04059675 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.8180 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -3.0790 -2.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 -4.2400 -2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 -4.1500 -3.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4080 -2.8280 -3.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -2.1980 -3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -0.9110 -4.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -0.2700 -4.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 -0.8960 -4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4250 -2.1620 -4.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5590 -5.3820 -3.1160 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 -6.7310 -2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 -7.8810 -2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8370 -7.7980 -2.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3390 -9.0010 -1.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2670 -10.1300 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 -11.3980 -1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2470 -11.5890 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 -10.3950 -1.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9870 -9.1180 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8480 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.2170 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.7630 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -5.0950 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.4160 -3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 0.7280 -5.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0010 -0.3790 -5.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3810 -2.6420 -4.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 -7.0640 -2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4600 -6.3780 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5160 -10.2610 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 -9.9360 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2290 -12.2600 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4240 -11.3020 -2.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 -11.6610 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 -12.5040 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -10.5430 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -10.3080 -2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 -8.2560 -1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 -9.1650 0.2350 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END