IFLAB-ZINC00114494 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -0.2280 -0.9740 -1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -2.2270 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 -2.3790 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -1.2650 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -0.0030 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 0.1350 -1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 -1.4200 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8640 -0.6060 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0930 -1.1230 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4320 -0.7240 -0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3720 -1.4350 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0090 -2.5530 0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6960 -2.9650 0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7200 -2.2560 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 -2.4090 0.1240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -3.1100 0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 0.6000 -1.9850 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7590 0.6050 -2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8250 0.5480 -3.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6690 -0.6770 -3.8530 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7400 -0.6320 -5.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 -1.7400 -3.2940 O 0 5 0 0 0 0 0 0 0 0 0 0 4.9110 1.8530 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0570 2.9240 -1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2130 4.0730 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2220 4.1500 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0740 3.0790 0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9160 1.9290 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -0.8600 -2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -3.0890 -2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -3.3580 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 0.8630 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 1.1100 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7220 0.1440 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4070 -1.1260 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7640 -3.1060 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4240 -3.8370 1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 1.4150 -3.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8080 0.5540 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 2.8630 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 4.9090 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3430 5.0480 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8630 3.1400 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5810 1.0910 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END