IFLAB-ZINC04942033 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0280 1.5220 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 0.0150 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.6800 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0010 1.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -2.7250 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.0940 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6920 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 0.1470 -2.7500 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 0.3260 -3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 1.0380 -4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 1.3900 -5.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 1.2840 -4.7900 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 1.8580 -6.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 2.7980 -6.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 3.3640 -7.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 2.9930 -8.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 2.0540 -8.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5210 1.4920 -6.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0260 3.5500 -9.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1800 3.1220 -10.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.9300 -2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -2.4270 -3.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -4.2720 -2.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.8310 -0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -6.0430 -0.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -4.1080 0.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -4.7930 1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -5.1320 -3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 1.9030 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 1.8760 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.8770 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.1300 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 0.9060 -2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -0.6590 -3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 1.0640 -4.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 3.0870 -5.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 4.0950 -8.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 1.7650 -8.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2210 0.7640 -6.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2210 3.6430 -11.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0770 3.3490 -9.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 2.0470 -10.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -4.9800 1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -5.7400 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -4.1670 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -5.3280 -3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -6.0740 -3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -4.6340 -4.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 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 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 M END