OTAVA-ZINC05372550 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.4800 -0.2320 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 0.3250 -0.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -0.3040 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 0.2550 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -0.2960 -3.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -1.4140 -3.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -1.9750 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -1.4220 -1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -2.0570 -4.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 -1.5000 -5.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 -2.2630 -7.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -3.4370 -7.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 -1.4920 -7.9230 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 -0.2810 -7.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 0.0940 -5.9570 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 0.7460 -8.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 0.8190 -9.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -0.2630 -10.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5650 -0.1360 -11.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1620 1.0750 -11.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 2.1650 -10.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3320 2.0560 -9.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2140 3.2500 -8.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5450 3.0410 -7.6490 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8570 -1.2570 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -0.1880 1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 0.3720 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 1.1230 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 0.1550 -4.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -2.8510 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -1.8920 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -3.1050 -4.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0470 1.6750 -7.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 -1.2250 -9.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6530 -0.9880 -12.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7180 1.1730 -12.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5160 3.1110 -11.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 4.3370 -9.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 38 2 0 0 0 0 M CHG 1 24 -1 M END