ASINEX-ZINC04891696 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.3670 1.4650 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -0.0440 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0880 -0.5370 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -0.5390 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -2.0340 1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -2.3950 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -1.9280 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -0.4250 -1.1850 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7340 0.1570 -1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -0.1400 -3.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 0.4340 -4.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 1.7880 -5.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 2.3350 -6.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 1.5410 -7.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 0.1930 -6.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -0.3650 -5.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -0.6470 -7.5400 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7450 -0.1490 -8.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -1.8060 -7.1460 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5750 2.0230 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 1.8350 -0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 1.7050 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 0.0100 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -0.3290 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -2.3330 2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -2.5940 1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 -1.9370 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -3.4800 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -2.1670 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -2.5000 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -1.1940 -3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 0.4040 -3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 2.4350 -4.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 3.3850 -6.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 1.9890 -7.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -1.4170 -5.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -0.0540 -2.4810 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7180 -0.6230 -2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 0.9160 -2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 37 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 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M CHG 1 37 1 M END