IFLAB-ZINC04263178 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.8480 1.0190 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -0.4140 0.1030 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1990 -1.0960 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.6960 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -2.2910 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -1.9390 -1.3760 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1350 -2.6190 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -0.5920 -1.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -2.0410 -2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -2.5110 2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -4.0270 2.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5590 -4.5560 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 -4.5100 3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 -5.9330 3.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -6.5930 4.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 -5.9890 6.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 -6.7660 7.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -8.1400 7.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 -8.7450 5.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -7.9860 4.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -10.2350 6.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 -10.3920 7.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8620 -9.1670 8.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -4.3320 2.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -5.2640 2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 1.7330 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 1.2160 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 1.2160 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -0.0180 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -0.6370 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -3.3340 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -1.6270 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -3.0540 -3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -1.7780 -3.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -1.3390 -2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -2.0010 3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1820 -2.1840 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -4.2300 3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -4.0790 4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 -4.9130 6.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 -6.2960 8.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -8.4640 3.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -10.6870 5.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -10.6670 5.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -10.3890 7.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 -11.3350 7.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 -9.3430 8.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 -8.8900 9.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -2.0970 1.0550 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4410 -2.7800 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 30 1 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END