IFLAB-ZINC02710650 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 1.4200 3.0850 -2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 3.4600 -3.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 4.7280 -3.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 5.6320 -2.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 5.2510 -1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 3.9770 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 3.5690 0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 4.3220 1.1240 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 5.7620 1.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 3.6710 2.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8740 3.8450 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 4.6570 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6830 4.3020 -1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3250 3.1540 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7640 2.3350 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5250 2.6920 0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5180 1.1140 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6590 0.9770 0.1800 O 0 5 0 0 0 0 0 0 0 0 0 0 7.5480 2.8260 -1.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 5.1790 -5.6650 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 6.6020 -5.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 4.8700 -6.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 4.2660 -6.2450 N 0 5 0 0 0 0 0 0 0 0 0 0 -1.3950 4.5440 -5.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 2.0980 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 2.7720 -4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 6.6180 -3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 5.9470 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 2.5690 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9520 5.5600 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1430 4.9150 -1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0860 2.0710 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8380 1.9850 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9890 0.3530 1.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 34 2 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 1 18 -1 M CHG 1 23 -1 M END