PUBCHEM-ZINC03922669 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -2.3410 -6.2060 -4.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -5.6140 -3.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -4.3460 -3.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -3.7010 -2.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 -2.4350 -2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -1.8170 -3.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -0.3540 -2.3660 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -0.7190 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -1.8210 -0.8400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 0.0550 0.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 -4.2360 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 -5.3280 -1.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -3.5100 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0790 -3.9900 0.9770 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2000 -5.0730 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 -3.4190 2.3680 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9020 -4.1300 3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0310 -2.5710 2.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3940 -3.2300 0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3780 -3.2200 0.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3960 -1.4090 2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4900 -0.7500 3.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -1.0990 3.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 -2.2700 2.4930 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 0.5140 4.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8830 1.6280 3.2390 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5440 1.7280 2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1870 2.9320 1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2820 3.5560 2.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 2.7690 3.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 3.0570 4.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 2.6520 4.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 2.8080 5.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 4.7840 2.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7870 -0.9220 2.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6460 -1.5960 2.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -5.5540 -5.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -6.3420 -4.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -7.1740 -4.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 -2.1590 -4.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 0.8710 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -0.2190 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 -2.6700 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -0.1860 3.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9510 -1.5560 4.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 0.3880 4.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3450 0.7270 5.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2440 1.0030 1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5620 3.3010 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 4.1240 4.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 2.4940 5.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 1.6100 3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 3.2850 3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 2.5680 5.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 5.2780 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 5.1470 2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1050 0.2700 3.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0410 0.5120 3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 33 54 1 0 0 0 0 34 55 1 0 0 0 0 34 56 1 0 0 0 0 35 36 2 0 0 0 0 35 57 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 26 1 M END