IFLAB-ZINC04941711 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.4240 1.1210 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -0.2700 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -1.0840 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 -1.8680 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -2.6330 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -2.8680 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 -4.1850 0.5380 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 -4.6100 0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 -3.9020 0.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4370 -5.9520 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -6.6600 1.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6870 -6.3770 1.6990 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8820 -7.5790 2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 -8.1730 3.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5790 -9.3510 3.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7640 -9.4800 3.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9770 -8.3760 2.2890 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1170 -8.1370 1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7360 -9.1860 0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8580 -8.9480 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3660 -7.6640 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7500 -6.6160 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6310 -6.8510 1.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4640 -7.4330 -0.7860 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 -10.1560 4.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 -8.9440 5.2850 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -7.8600 3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 1.8630 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 1.3460 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 1.1440 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -0.2930 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -0.4950 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -1.4460 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -0.0250 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -1.5700 -3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 -1.6580 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 -2.9360 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -2.7560 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -3.3530 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -2.0970 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -2.8280 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -4.7500 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4500 -5.8450 1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3400 -10.1870 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3400 -9.7630 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1480 -5.6160 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1540 -6.0350 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 -10.5150 5.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 -10.9880 4.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 -8.1100 3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -6.8110 4.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -1.2700 -0.7730 N 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 31 1 0 0 0 0 2 32 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 52 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 52 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 43 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 M END