IFLAB-ZINC04248830 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 -0.0620 1.5020 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.0050 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -0.7140 1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -2.0940 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.7710 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -2.0560 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.6750 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -2.7860 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1700 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -4.8480 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -4.2510 2.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -6.3490 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -6.9610 2.8180 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -8.6900 2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -9.2620 1.3270 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -10.5920 1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -10.8630 2.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -9.6590 3.4540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -9.4590 4.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -9.3970 5.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -10.5550 5.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -10.5030 6.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 -9.2880 6.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5230 -8.1210 6.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -8.1800 5.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -7.0700 6.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3660 -7.5480 7.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3980 -8.9680 6.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 1.8810 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 1.8720 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 1.8430 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -0.1870 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -2.6470 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -0.1190 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -2.9780 -2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -2.1760 -2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -3.7330 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -4.6510 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -6.7880 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -6.6280 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -11.3180 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -11.8390 3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -10.2890 5.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -8.5250 5.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -11.5030 5.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 -11.4090 6.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -7.2770 5.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -7.3360 8.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3370 -7.1020 6.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 M END