IFLAB-ZINC04164640 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 0.8330 1.7550 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 0.2440 0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -0.4480 1.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -1.9460 1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -2.7280 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -4.1150 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -4.7420 1.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -3.9670 2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -2.5780 2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -6.1020 1.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -6.7940 2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -8.2880 1.8710 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2340 -8.4180 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -9.0610 2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -10.9640 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -12.4830 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -12.7670 2.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -11.2400 2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -14.7200 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1070 -15.4370 1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -8.8360 2.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -9.7950 2.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 2.0410 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 2.2310 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 2.1510 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -0.0050 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -0.1140 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 -0.1900 1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -0.0830 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 -2.2650 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 -4.7090 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -4.4070 2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -1.9910 3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -6.6340 3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -6.4270 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 -8.8260 3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 -8.7260 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -10.4880 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -10.6690 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -12.7830 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -12.8080 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -13.1000 3.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9800 -13.2510 3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2160 -10.9580 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -10.9530 3.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -15.0400 1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -14.9130 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -15.3500 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -15.0440 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0070 -16.5040 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 -10.5270 2.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -13.2230 1.2400 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8320 -12.9550 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 51 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 52 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 52 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END