IFLAB-ZINC02107494 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 68 0 0 1 0 0 0 0 0999 V2000 0.1310 1.4760 -0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 0.0100 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -0.2900 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -0.2590 0.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5850 0.3110 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 -1.7290 0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -2.4480 -0.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -2.2450 1.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -3.5790 1.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -4.1790 2.9550 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -5.4600 3.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 -5.9830 2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 -4.7150 0.8730 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -6.2600 4.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -5.6710 5.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -6.4210 6.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -7.7540 6.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -8.3440 5.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 -7.6030 4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -8.7060 7.8830 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -10.0640 7.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 -8.0600 8.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -8.5640 9.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 -9.5110 9.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -10.0370 10.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -8.9310 11.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -8.1130 11.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -7.4920 10.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 0.1480 -0.8960 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 1.0830 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5170 1.7140 0.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1060 1.2140 -1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1780 1.9980 -2.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6840 1.8720 -3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1270 0.9700 -4.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0540 0.1800 -4.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 0.2950 -2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -0.3600 -2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -1.2170 -2.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 1.6680 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 1.6900 -1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 2.1170 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -0.6300 -1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 0.2870 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 -1.3540 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -0.0180 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 -1.6850 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -7.0030 1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -4.6300 5.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -5.9660 7.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -9.3860 5.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 -8.0630 3.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 -9.0020 8.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -10.3410 8.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 -10.6320 10.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -10.6560 10.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -7.3240 12.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -8.7250 11.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -6.9860 9.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -6.7760 9.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6170 2.7040 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5200 2.4820 -3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 0.8810 -5.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 -0.5240 -4.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 43 1 0 0 0 0 3 44 1 0 0 0 0 3 45 1 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 29 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 48 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 29 38 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 34 62 1 0 0 0 0 35 36 2 0 0 0 0 35 63 1 0 0 0 0 36 37 1 0 0 0 0 36 64 1 0 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 M END