IFLAB-ZINC04170214 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -0.4730 0.8190 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -0.3170 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -0.7830 -0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -0.1120 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 1.0200 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 1.4860 0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 -0.6560 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 0.1000 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0060 -0.4160 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0840 -1.7920 -0.4200 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1030 0.3510 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4370 -0.2620 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4460 0.8320 -0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6430 0.6690 -0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7500 2.0130 -0.1800 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3020 1.8420 -0.0300 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8420 2.3680 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7980 2.3910 1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 3.3090 1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2810 3.7900 2.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9060 3.3470 3.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9380 2.4780 3.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3520 2.0150 2.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4160 3.3100 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7980 3.7450 -1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6600 5.6870 -2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5530 6.9260 -2.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8920 6.5760 -2.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9430 5.9630 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1240 4.6730 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6660 -1.4600 -0.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 1.1790 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -0.8440 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -1.6730 -1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 1.5440 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 2.3650 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 -1.7410 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 1.1790 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2620 3.6530 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 4.4900 2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5830 3.6890 4.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1770 1.3110 2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7720 4.0600 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3120 3.2070 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3350 2.9650 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8880 3.9950 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6230 5.9590 -3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0280 4.9640 -3.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5880 7.4040 -3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1650 7.6620 -2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9920 5.7390 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5910 6.6760 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5000 3.9470 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1230 4.2390 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0290 -2.0700 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6780 4.9820 -1.6030 N 0 3 0 0 0 0 0 0 0 0 0 0 10.2960 5.6450 -0.9130 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 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 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 55 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 31 2 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 56 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END