IFLAB-ZINC04173425 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 0.0240 1.3030 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.0070 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -0.7400 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -1.6740 1.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -3.0110 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 -3.9400 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -5.0550 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 -1.2180 2.5660 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -2.4180 3.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -0.1810 2.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.4840 3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -1.2710 4.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -0.7020 5.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 0.6710 5.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 1.4590 4.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 0.8780 3.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 1.2870 5.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8110 0.5980 6.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 2.6120 5.8910 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 3.1790 6.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7840 2.6830 7.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 3.2410 8.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5490 4.2890 8.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 4.8250 6.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1600 4.2690 6.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8400 4.8080 4.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 5.8600 4.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6050 6.4120 5.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 5.9060 6.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 1.8580 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 1.8280 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -0.5620 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -1.2920 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -0.0220 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -3.3850 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -2.9590 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -3.6880 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 -5.3070 1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 -5.7210 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -2.3320 4.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -1.3170 5.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 2.5210 4.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 1.4880 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 3.1720 5.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 1.8520 8.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0850 2.8360 9.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3600 4.7090 8.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 4.3920 4.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 6.2740 3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1570 7.2460 4.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7670 6.3430 6.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 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 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 43 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 44 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 M END