PUBCHEM-ZINC02972483 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -1.7980 1.6450 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 0.3120 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 0.4270 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -0.7840 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -1.3370 1.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -1.1510 -0.4460 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 -2.1190 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4130 -3.5450 0.3660 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7020 -3.7520 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 -4.6250 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7440 -4.4690 0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6620 -5.5150 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2830 -6.6950 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0720 -6.8890 -0.3100 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 -5.8560 -0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -4.6100 1.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 -4.3760 2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 -4.2200 4.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 -3.2370 4.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 -3.4960 2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 -4.9160 5.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 -5.3570 6.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -6.0590 7.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -6.3430 7.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -5.9170 6.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -5.2170 5.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -7.0320 8.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -7.3460 9.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 2.4440 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 1.5950 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 1.9280 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 0.0370 -1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 0.7130 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.5280 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 1.1790 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2210 -0.7070 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4400 -1.6760 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7600 -2.1840 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0410 -3.5430 1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6510 -5.4120 1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9630 -7.5400 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2460 -6.0650 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 -4.5740 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -5.5730 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -5.2280 2.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -3.4750 2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8860 -3.2210 5.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -2.2360 4.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 -4.4630 3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0510 -2.6950 2.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 -5.1910 6.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 -6.3910 8.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -6.1040 6.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -4.8790 4.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -7.8930 9.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -7.9960 8.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -6.4360 9.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 -3.5320 1.6440 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0300 -2.6190 1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 58 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END