IFLAB-ZINC04223602 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 0.3420 1.5080 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 0.0560 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -0.8550 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -1.6880 -1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -1.8920 -3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -1.6600 -3.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 -0.9960 -2.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 -0.7500 -2.4620 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 -1.4460 -4.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2470 -1.9550 -4.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 -2.6250 -5.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -2.3770 -6.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -3.6140 -5.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6070 -1.4810 -4.8550 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8950 -1.0570 -4.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3310 -0.5390 -3.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8370 -1.2940 -5.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9630 -2.6140 -6.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8280 -2.9020 -7.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5700 -1.8790 -7.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4650 -0.5530 -7.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5870 -0.2360 -6.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5100 1.1170 -5.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2730 2.1130 -6.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1300 1.7840 -7.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2260 0.4620 -7.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -0.5110 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 1.6130 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 2.1450 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 1.8980 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 0.0220 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -0.5480 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -1.8970 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -0.8090 1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -1.6020 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -2.5180 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -2.9040 -3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -1.1950 -3.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -3.9510 -4.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 -4.0580 -6.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4020 -1.8610 -5.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4030 -3.4240 -5.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9300 -3.9230 -7.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2410 -2.1290 -8.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8540 1.4140 -5.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1980 3.1430 -6.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7240 2.5570 -8.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9050 0.2290 -8.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -1.2160 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 0.4860 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -0.4100 -1.1130 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6690 0.3240 -1.8240 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 2 31 1 0 0 0 0 2 51 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 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 4 36 1 0 0 0 0 4 51 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END