IFLAB-ZINC05258113 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 -0.0620 1.5020 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.0050 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -0.7140 1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -2.0940 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.7710 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -2.0560 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.6750 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -2.7860 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1700 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -4.8480 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -4.2510 2.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -6.3490 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -6.8660 2.5550 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4080 -6.5120 3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -8.3730 2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -8.9730 2.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -6.3170 4.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -5.7980 5.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 -5.7420 6.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1210 -5.2220 7.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 -5.1660 8.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3350 -4.6470 9.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 1.8810 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 1.8720 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 1.8430 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -0.1870 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -2.6470 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -0.1190 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -2.9780 -2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -2.1760 -2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -3.7330 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -4.6510 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -6.7880 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -6.6280 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -7.3160 5.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -5.6480 4.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 -6.4670 4.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 -4.7990 4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -5.0730 7.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 -6.7410 7.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 -5.8910 7.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 -4.2230 6.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2060 -4.4970 9.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 -6.1650 9.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1470 -5.3160 9.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5340 -3.6480 9.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 -5.4940 11.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -9.0490 2.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -6.3710 3.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 -6.9340 2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2370 -4.5930 10.8710 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0950 -4.2530 11.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -10.0150 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 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 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 49 1 0 0 0 0 15 16 2 0 0 0 0 15 48 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 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 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 51 1 0 0 0 0 47 51 1 0 0 0 0 48 53 1 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 M END