IFLAB-ZINC05259586 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0470 1.5340 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 0.0120 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -0.5250 1.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -1.8720 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -2.4590 2.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8250 2.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -4.6220 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -4.0280 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -2.6620 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -6.0870 1.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -6.6010 3.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -6.8540 0.8370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -8.2260 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -9.1070 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -10.4620 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -10.9480 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 -10.0620 2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -8.7080 2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -12.4040 1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -12.8940 2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 -14.2610 2.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -15.0660 1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -14.5160 0.5900 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -13.2490 0.4980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -16.4110 1.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -17.1740 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 1.9500 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 1.9430 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 1.7920 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -0.4050 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -0.2470 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -1.8420 3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -4.2800 3.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -4.6410 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -2.2030 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -6.4530 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -8.7300 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -11.1460 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -10.4370 3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -8.0220 2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 -12.2260 3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 -14.6920 3.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -18.2320 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -17.0130 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -16.8570 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 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 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 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 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END