IFLAB-ZINC05258004 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 0.1290 -0.1560 2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 1.2830 4.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 2.1340 2.5280 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8170 1.8590 1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 3.2230 3.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 2.7500 2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 1.6500 2.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 3.5500 3.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2940 3.1560 2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3070 3.5120 3.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6080 3.1240 3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9040 2.3780 2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8900 2.0220 1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5900 2.4140 1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2220 1.9840 2.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6450 1.7680 0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6070 0.8020 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0240 0.5920 -0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4850 1.3400 -1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5280 2.3020 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1100 2.5220 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 2.6520 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 2.0950 3.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -1.0160 3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 0.1500 2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -0.4240 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 1.5730 4.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 0.4110 5.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 2.1080 5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 3.4360 4.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 4.1290 2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7960 4.3980 3.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0770 4.0920 4.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3950 3.4000 4.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1200 1.4420 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8030 2.1410 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8420 1.8610 2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0270 0.2170 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7710 -0.1590 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8120 1.1730 -2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1090 2.8850 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3660 3.2760 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 0.9540 3.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 3.7310 1.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 4.0260 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 43 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 22 1 0 0 0 0 3 43 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 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 32 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 44 45 1 0 0 0 0 M END