PUBCHEM-ZINC04186627 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 71 0 0 0 0 0 0 0 0999 V2000 -3.7620 0.8930 -1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 -0.1190 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 -0.2190 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -1.1460 0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -1.9760 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -1.8770 -1.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 -0.9480 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -2.7160 -2.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -2.2990 -3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -3.4340 -4.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -4.4980 -3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -3.9900 -2.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 -5.9320 -3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -6.8840 -2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -8.2160 -2.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -8.6090 -3.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -7.6630 -4.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 -6.3300 -4.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -9.9220 -4.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -10.2560 -5.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -0.9170 -4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 0.0130 -3.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -0.6830 -5.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 0.6750 -5.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 0.9910 -6.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -0.0670 -7.9990 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -1.3640 -7.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -1.7780 -6.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 0.2660 -9.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 -0.6100 -10.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -0.2780 -11.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 0.9260 -11.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9640 1.8000 -10.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 1.4710 -9.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 1.2790 -12.3420 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0960 0.5100 -13.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 2.3390 -12.3420 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1710 -2.9850 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 1.8560 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2230 0.5610 -2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5290 0.9940 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 0.4290 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -1.2220 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -0.8720 -2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -3.4920 -5.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -6.5780 -1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -8.9540 -2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -7.9720 -5.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -5.5960 -5.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -9.9490 -6.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -9.7420 -5.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -11.3340 -5.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 1.3930 -5.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 0.7260 -6.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 1.0410 -6.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 1.9480 -7.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -1.2810 -6.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -2.1150 -8.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -1.9580 -6.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -2.6820 -5.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -1.5500 -10.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 -0.9580 -12.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4970 2.7390 -10.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 2.1520 -8.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -3.9520 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -3.0770 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -2.6570 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 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 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 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 8 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 45 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 18 2 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 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 28 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 62 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 63 1 0 0 0 0 34 64 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 38 65 1 0 0 0 0 38 66 1 0 0 0 0 38 67 1 0 0 0 0 M CHG 1 35 1 M CHG 1 37 -1 M END