ASINEX-ZINC06680879 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.0030 1.4880 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.0410 -0.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5130 -0.3940 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -0.5560 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -2.0850 1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -2.6330 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -2.0300 0.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -0.5660 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 -2.9830 -0.9900 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 -2.2080 -2.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -4.2510 -0.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8310 -3.2330 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8760 -2.3890 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0510 -2.7590 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7860 -4.2180 0.8870 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.1390 -4.2610 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3280 -2.0520 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4000 -1.0460 -0.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4240 -2.5160 0.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6210 -1.7900 0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9580 -1.0820 -0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1400 -0.3670 -0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9880 -0.3550 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6580 -1.0590 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4780 -1.7830 1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1550 -2.4800 2.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0820 -2.4270 3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 1.8610 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.8540 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 1.8400 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -0.1640 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -0.2230 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -2.4180 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -2.4500 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 -3.7160 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -2.3770 2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1410 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -0.2850 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 -1.5210 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4370 -5.0160 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3830 -3.3520 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2980 -1.0890 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4020 0.1840 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9100 0.2050 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3220 -1.0470 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2040 -1.3930 4.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0450 -2.8220 3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7040 -3.0240 4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END