IFLAB-ZINC04139354 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 2.4560 0.5930 1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -0.8170 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 -1.8860 1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -3.1950 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -3.4470 0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -2.3840 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -1.0750 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -4.8460 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 -5.6560 0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -5.1770 -0.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -6.5210 -0.7380 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0890 -7.1980 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -6.7170 -0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -6.8390 -2.1450 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3600 -6.7780 -2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -5.8060 -3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -4.7050 -3.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -3.9400 -4.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -4.4810 -4.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 -5.9070 -4.0310 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -9.3520 -1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -10.7580 -2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -10.0260 -4.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -8.6070 -3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -12.3830 -3.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 1.0120 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 1.2220 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 0.6290 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -1.7050 2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 -4.0130 1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.5430 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -0.2520 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -4.4890 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -5.9340 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -7.6900 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -6.6570 0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -4.4520 -3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -3.0370 -5.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -4.1060 -5.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -9.1790 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -9.2310 -1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -11.4870 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -10.8630 -2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -10.0770 -4.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -10.2180 -5.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 -8.4940 -3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -7.8830 -4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -12.5140 -4.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -13.1330 -3.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -12.6000 -4.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -8.2880 -2.6170 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9570 -8.3530 -2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -11.0340 -3.3300 N 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 51 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 51 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 53 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 51 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 53 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END