IFLAB-ZINC00122213 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 0.9150 1.5180 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 0.0250 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -0.7890 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -2.1750 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -2.7720 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -1.9830 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -0.5740 -0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 0.2730 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -2.4830 -2.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -3.8910 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -4.2760 -3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -3.4370 -4.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -5.6600 -4.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -6.3950 -5.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -7.7920 -5.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -8.6030 -6.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -8.0240 -7.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -6.6290 -7.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -5.8230 -6.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -6.0140 -9.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -4.7450 -9.1320 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5970 1.9440 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 1.9730 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 1.7900 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.3460 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -2.7930 2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -3.8550 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 0.4460 -2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -0.2040 -2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 1.2380 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -4.3300 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -4.3210 -1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -6.2220 -3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -8.2720 -4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -9.6850 -6.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -8.6630 -8.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -4.7440 -6.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -6.8140 -10.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 27 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 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 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 33 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 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 2 0 0 0 0 M CHG 1 21 -1 M END