ASINEX-ZINC04719009 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8150 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -2.5530 0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -2.3880 2.5190 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4120 -1.7890 2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -2.3710 3.7290 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2930 -2.9700 3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 -2.9440 4.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -2.1330 5.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -2.6580 6.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -3.9950 7.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -4.8060 6.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -4.2790 5.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -6.2370 6.6850 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2340 -6.7000 7.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -6.9520 6.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1920 -1.0040 4.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -0.8250 4.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -1.7790 4.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.5660 4.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -3.7670 2.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -4.6940 1.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -4.3860 1.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -6.1130 1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 -1.0880 5.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 -2.0250 7.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 -4.4060 7.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -4.9120 4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 1.2900 4.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 0.7690 4.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 0.6440 5.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -4.0130 2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -6.6870 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -6.5620 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 -6.1160 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END