ASINEX-ZINC04512578 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -0.7190 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -0.8520 0.0110 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -2.1330 0.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 0.0140 0.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -1.0940 -1.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -2.2890 -2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -1.8420 -3.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 -0.9880 -4.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 0.2420 -3.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 -0.1230 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -0.6960 -5.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -0.0310 -5.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 0.2470 -7.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -0.7530 -8.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -1.0740 -6.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 -1.7550 -6.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 -2.1020 -7.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3870 -1.7880 -9.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 -1.1270 -9.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2760 -2.2480 -10.4780 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 -0.9020 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -1.6700 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -0.1170 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -2.8260 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -2.9360 -2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -1.2810 -3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -2.7180 -4.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 0.7740 -3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6850 0.8770 -4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 -0.5660 -2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 0.7720 -1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 0.2710 -4.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 0.7660 -7.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -2.0030 -5.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 -2.6270 -7.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -0.8910 -10.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -0.1040 -8.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 15 42 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 41 1 0 0 0 0 M END