IFLAB-ZINC03124428 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4280 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -0.6870 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 -0.1260 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 -0.9390 -0.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7010 -2.4370 -0.0620 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0960 -2.9250 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 -2.4450 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2140 -3.0820 -1.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 -4.2670 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0020 -4.7990 -0.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3680 -4.9180 -2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0290 -6.1450 -2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5090 -6.7480 -3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3360 -6.1400 -4.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6820 -4.9240 -4.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1920 -4.3130 -3.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8500 -0.6150 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2270 -0.0700 -2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9640 0.2270 -3.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3240 -0.0190 -3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9470 -0.5630 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2110 -0.8560 -1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 -0.6420 1.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9860 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0940 -2.6580 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1660 -6.6200 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0210 -7.6970 -3.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7140 -6.6160 -5.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5500 -4.4550 -5.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6780 -3.3660 -3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1650 0.1220 -2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4780 0.6520 -4.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9000 0.2120 -4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0100 -0.7560 -2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6990 -1.2780 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1290 0.2760 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 M END