OTAVA-ZINC05020942 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -0.3700 1.0850 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -0.2870 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -0.8340 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -0.0090 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 1.3630 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 1.9100 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -0.6050 -0.0520 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5090 -1.6500 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 -0.5140 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 -1.2270 -1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8190 -1.8430 -0.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 0.1330 0.8400 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7020 -0.4030 2.3850 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 0.4810 2.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 -0.6400 2.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 -1.9740 2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8700 -2.0610 2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4900 -3.2930 2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7310 -4.4390 2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 -4.3510 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7330 -3.1190 2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5410 -5.5780 1.8550 N 0 3 0 0 0 0 0 0 0 0 0 0 5.0870 -6.6630 1.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 -5.5010 1.8000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3610 1.5120 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -0.9310 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -1.9050 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 2.0070 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 2.9810 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -0.9810 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1950 0.5330 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8900 0.9350 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4630 -1.1670 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5660 -3.3620 2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2150 -5.4010 2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 -3.0520 2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 -1.1780 -2.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -1.6510 -2.7510 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 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 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END