ASINEX-ZINC04704352 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0850 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7730 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0790 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6920 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.0070 -2.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.7800 -3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 0.1570 -4.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -0.6710 -6.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 0.2520 -7.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 1.4530 -7.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -0.2580 -8.5130 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 0.5930 -9.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 1.8880 -9.5470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 2.5430 -10.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 1.7640 -11.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 0.0850 -11.2440 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 2.2300 -13.1820 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2320 3.4230 -13.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 1.4200 -14.0920 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0680 -2.9590 2.6870 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8520 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6160 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -1.3970 -3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -1.4210 -3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 0.7740 -4.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 0.7970 -4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -1.2880 -6.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -1.3120 -6.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -1.2190 -8.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 3.6210 -10.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 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 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END