IFLAB-ZINC04305543 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -6.0130 -9.5910 -2.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7830 -8.9410 -2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5960 -8.9160 -0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -8.3220 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5210 -7.7460 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 -7.7750 -2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 -8.3760 -3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0480 -8.4130 -4.6370 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0970 -8.5730 -5.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1670 -8.2820 -5.0980 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3140 -7.1080 -0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -6.5200 -1.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -7.1770 0.6240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -6.6410 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -6.9720 2.6620 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1410 -6.4890 3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -8.4650 2.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 -9.1280 3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -10.4990 3.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -10.9490 3.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -9.5970 2.7790 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -6.4880 3.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 -6.8960 4.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -5.6630 5.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -4.5320 4.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 -5.0910 3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -4.2490 2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -2.8810 2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -2.3350 3.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -3.1630 4.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8000 -8.8450 -3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7750 -10.0190 -3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3560 -10.3800 -2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3320 -9.3620 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3270 -8.3030 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -7.3310 -3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -7.5830 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -7.0870 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -5.5590 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -8.6340 3.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -11.1550 3.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -11.9840 3.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -7.0780 5.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -7.7760 4.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -5.5020 6.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -5.7740 5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 -4.6700 1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -2.2340 1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -1.2630 3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -2.7380 5.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 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 36 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END