IBS-ZINC02204393 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 0.3540 1.5170 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -0.0030 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -0.3830 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -0.5890 0.3400 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5430 -0.3700 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -2.1240 0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -2.7290 1.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -2.7700 -0.7310 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -4.2170 -0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -4.6880 -2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -6.2130 -2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -6.6740 -3.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -8.1940 -3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -8.7340 -5.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -7.8750 -5.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -0.0420 1.3890 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 0.1370 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 -0.1030 0.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 0.6440 2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4350 0.8630 2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1490 1.3430 3.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4860 1.6010 4.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 1.3770 4.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 0.8920 3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 0.6760 3.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 0.2240 2.6020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 1.8970 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 1.7930 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 2.0310 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -0.4240 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 0.1100 2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -1.4640 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -0.0800 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -2.2410 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -4.5540 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 -4.6180 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -4.3220 -2.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -4.2480 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -6.5760 -1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -6.6500 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -6.3040 -4.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -6.2300 -3.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -8.5610 -2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -8.6360 -3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9500 0.6600 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2190 1.5160 3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0390 1.9750 5.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 1.5800 5.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -9.9960 -5.1290 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 16 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 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 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 49 1 0 0 0 0 16 17 1 0 0 0 0 16 26 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 24 2 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 M CHG 1 49 -1 M END