IFLAB-ZINC05239810 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 0 0 0 0 0 0999 V2000 1.0640 1.5820 2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 0.4730 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -0.4270 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 -1.1820 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -2.0140 0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -2.5780 1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 -3.9540 1.6820 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 -4.2780 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 -5.4770 0.8190 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3570 -5.4220 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1320 -6.5270 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3930 -6.3180 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8840 -5.0270 -0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1310 -3.9150 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8670 -4.1390 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7130 -3.0040 0.6390 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -4.9510 2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -4.6300 2.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -6.4280 1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -7.3070 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -9.0690 2.2450 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -9.8620 2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -10.9580 1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -11.6240 2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 -11.2060 3.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 -10.1240 3.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 -9.4590 3.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 1.2180 3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 2.3950 2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 2.0050 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 0.8080 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 0.1010 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -0.7200 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 0.6460 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -0.8820 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9070 -0.9630 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 -2.2650 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -1.8440 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -2.7110 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -1.9330 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 -2.5880 2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7470 -7.5340 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9920 -7.1720 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8680 -4.8800 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5200 -2.9100 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -6.6500 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 -6.6300 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -7.0770 3.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -7.1190 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -11.3040 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -12.4700 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 -11.7240 3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 -9.8020 4.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -8.6350 4.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -0.6840 1.2440 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1930 -0.7610 2.2350 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 31 1 0 0 0 0 2 32 1 0 0 0 0 2 55 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 55 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 55 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 17 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 42 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 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 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 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END