IFLAB-ZINC04031649 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 0.0030 1.3310 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 1.9030 1.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 1.2750 2.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 1.7800 3.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 1.1460 4.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -0.0070 4.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -0.5110 3.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 0.1260 2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -0.6890 5.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -0.2490 6.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 -1.8010 5.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 -2.3850 6.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -3.7650 6.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 -4.3490 7.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3200 -3.5620 8.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1590 -2.1720 8.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 -1.5870 7.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7580 -1.3280 9.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4480 -1.7710 10.3780 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9300 -0.8760 11.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7040 -1.1040 12.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1060 -0.0630 13.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7650 1.2420 12.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0120 1.4960 11.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 0.4420 10.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 0.4250 9.4510 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0280 -4.1390 9.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 0.3130 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.9290 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 1.3150 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 2.6710 3.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 1.5380 5.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 -1.4010 2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -0.2650 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 -2.1960 4.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 -4.3830 5.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 -5.4220 7.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 -0.5150 7.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9780 -2.1130 12.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6960 -0.2550 14.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0910 2.0590 13.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 2.5110 11.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9720 -4.2330 9.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 27 43 1 0 0 0 0 M END