IBS-ZINC04116224 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0220 -0.6800 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.0080 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.7280 3.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.1240 3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.8310 2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.1470 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.8100 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.1360 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6680 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 0.0160 -2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.6940 -3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -2.0970 -3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.8110 -2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -0.0100 -4.7600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -0.7560 -6.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 0.2260 -7.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -0.5410 -8.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -0.4180 -9.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 -1.2920 -10.4650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -1.9200 -10.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -1.4620 -8.8680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -1.4350 -11.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 1.0710 2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.2070 4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -2.6550 4.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -3.9110 2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 1.0960 -2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -2.6210 -4.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -3.8900 -2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 0.9600 -4.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -1.3710 -6.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -1.3950 -6.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 0.8410 -7.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 0.8650 -7.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 0.2440 -9.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -2.6730 -10.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 11 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 M CHG 1 2 1 M END