OTAVA-ZINC01747981 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0090 1.3810 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 0.0000 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -0.6810 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 0.0190 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 1.4000 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 2.0860 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.4840 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 4.1440 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 3.5260 1.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 5.6090 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 6.3560 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 7.7410 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 8.7790 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 10.0760 0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 10.4080 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 9.4230 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 8.0810 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 6.6200 -0.3100 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 11.1460 1.2200 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.3920 10.8630 1.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 12.3110 0.9800 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2170 -2.4420 -0.0440 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -2.8390 0.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -2.8590 0.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -2.9170 -1.6140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -2.6210 -2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 -2.9460 -3.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0820 -2.5820 -3.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 -1.9200 -3.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 -1.7690 -1.5770 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 1.9120 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -0.5490 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -0.5160 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 1.9450 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 3.9800 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 5.9220 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 8.5380 1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 11.4430 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 9.6860 -0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -3.4020 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 -2.8020 -4.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8340 -1.5380 -3.2650 H 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 41 1 0 0 0 0 29 30 1 0 0 0 0 29 42 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END