PUBCHEM-ZINC06183485 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 67 0 0 0 0 0 0 0 0999 V2000 -1.5340 1.9260 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 0.8000 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -0.2410 0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -1.2860 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -1.2070 -0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -0.1270 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 0.8300 -1.1710 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5410 1.9650 -2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 3.0620 -1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 4.2480 -2.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 5.2980 -2.6230 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2800 5.4130 -3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 6.4970 -2.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 7.0410 -1.9100 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 7.8320 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 6.2720 -1.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -0.0280 -3.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -2.4240 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -2.3400 2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -1.3360 4.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -0.3150 5.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -0.6130 7.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -1.9260 7.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -2.9480 6.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -2.6520 5.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -3.6840 3.7790 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 0.1220 2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 0.7660 2.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 1.9660 3.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 2.5570 3.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 1.9470 3.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 0.7470 2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 0.1590 2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 2.4590 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 2.6130 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 1.5210 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -0.2610 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -1.9870 -1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 1.6380 -3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 2.3560 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 3.3900 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 2.6710 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 3.9200 -3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 4.6390 -2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 4.7520 -4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 6.8660 -3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 6.4360 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -0.5040 -3.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 1.0210 -3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -0.5300 -3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -3.3300 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 0.7160 5.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 0.1870 7.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -2.1510 8.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -3.9760 6.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 0.0160 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 0.7450 3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 2.4430 3.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 3.4950 4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3310 2.4080 3.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 0.2710 1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -0.7770 1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -1.2000 3.3710 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 2 0 0 0 0 18 51 1 0 0 0 0 19 26 1 0 0 0 0 19 63 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 20 63 1 0 0 0 0 21 22 2 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 32 2 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 M CHG 1 7 1 M CHG 1 11 1 M END