IFLAB-ZINC05239986 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6980 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0750 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7750 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0880 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6780 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.0950 -2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.9120 -2.2860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -4.1820 -2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.5040 -0.3380 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -5.1520 -3.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -6.4970 -2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -7.5400 -3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -7.2970 -4.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -5.9360 -5.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -4.9560 -3.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -8.2950 -5.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -9.4120 -4.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -8.0240 -6.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 -9.3160 -6.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 -9.0590 -7.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2190 -10.1100 -7.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1880 -9.9320 -8.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9630 -11.0010 -9.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7720 -12.2490 -8.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8060 -12.4290 -7.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 -11.3610 -7.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1580 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6140 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 0.2950 -2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -0.4910 -3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 1.0380 -2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -6.6590 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -6.5920 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -8.5400 -3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -7.4460 -4.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -5.8750 -5.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -5.6880 -5.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -3.9340 -4.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 -5.1400 -3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -7.6600 -7.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 -7.2720 -5.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 -9.6800 -5.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -10.0690 -6.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 -8.9580 -9.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7170 -10.8630 -9.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3780 -13.0840 -8.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6580 -13.4040 -7.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2820 -11.5010 -6.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 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 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 M END