PUBCHEM-ZINC06257749 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 69 0 0 1 0 0 0 0 0999 V2000 2.9100 -1.6570 4.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 -1.5070 3.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -1.9790 1.8830 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0030 -3.0330 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -1.0250 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 0.3120 2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -0.0530 2.9100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0700 -0.2340 1.9230 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0130 0.6000 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -1.5430 1.1700 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6610 -1.2710 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -2.6100 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -3.7000 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -3.7450 -0.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -4.6480 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -5.7830 -0.8840 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0820 -5.4050 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -6.8410 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 -7.2510 0.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -6.4530 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -6.3740 -0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 -6.1040 -0.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -7.2270 -2.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 -7.8060 -2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 -8.9180 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5240 -10.1690 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0230 -10.4560 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3760 -11.0670 -1.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0720 -10.2130 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5760 -9.9090 -2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -0.3100 2.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 0.5650 2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 0.9540 4.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -2.2260 4.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7830 -1.1500 3.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -1.2540 5.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -2.7170 4.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 -1.3630 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -0.9390 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 0.6760 2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 1.0890 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -3.1000 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6130 -2.1460 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -4.5660 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -7.7320 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -6.4540 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 -7.4400 -2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0370 -6.9960 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 -8.1950 -3.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 -9.8330 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4440 -8.5970 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2590 -9.6460 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9360 -11.0880 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3000 -11.1490 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6110 -9.5400 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3840 -10.7300 -3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6630 -9.2920 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 -10.8240 -2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3610 -9.2080 -3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 1.0820 4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 1.9350 3.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 0.6440 4.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -1.8700 5.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -2.0900 3.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -3.3050 4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1320 -9.2680 -1.2670 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.6490 -8.3850 -1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 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 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 33 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 66 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 66 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 30 66 1 0 0 0 0 31 32 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 66 67 1 0 0 0 0 M CHG 1 66 1 M END