IFLAB-ZINC04036048 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.8660 1.3200 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -0.2030 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -0.6420 1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -0.8410 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 -0.1460 0.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 -2.1840 0.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -2.9330 0.2600 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0900 -2.7080 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -4.4070 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -4.3250 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -3.0890 0.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -5.4810 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -5.2800 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -6.3620 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -7.6540 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -7.8580 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -6.7810 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 -8.7480 -0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 -9.1730 1.2710 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 -10.3010 0.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 -7.9680 1.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -9.6610 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1900 -2.6240 1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5110 -2.4820 1.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9540 -2.1980 2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 -2.1100 3.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 -2.4010 3.1120 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 1.7820 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 1.6330 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 1.6300 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -0.5130 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -1.7270 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -0.1810 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -0.3320 2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3130 -4.9180 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -4.9140 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -4.2760 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -6.2070 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -8.8630 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1690 -6.9400 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -9.2600 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -10.5510 2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -9.8750 3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -8.8490 2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1840 -2.5800 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9990 -2.0590 3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 -1.8970 4.9090 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 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 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 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 M END