PUBCHEM-ZINC03604224 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 0.1090 1.4020 -0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.0220 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.4910 -0.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -1.0800 -1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 -1.3660 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2870 -0.9010 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -0.3500 0.7870 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 -0.9120 1.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2330 -1.9940 1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2580 -1.9810 2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4080 -0.8880 3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 0.1900 3.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5020 0.1770 2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -1.9710 -1.8080 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2650 -2.0370 -2.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -1.4760 -2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -1.4150 -3.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -1.9520 -4.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 -2.5450 -5.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 -2.5970 -4.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4720 -1.0520 -2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5460 -1.6120 -2.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7650 -0.6930 -2.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4820 -2.4260 -3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7620 -0.0610 -4.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6670 -3.2780 -1.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 1.7270 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 1.4850 -1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 2.0930 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -0.7080 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -0.0910 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1290 -2.8670 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9340 -2.8280 2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2000 -0.8800 4.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 1.0400 4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 1.0220 2.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.9760 -3.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -1.9260 -5.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -2.9740 -6.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4170 -3.0800 -4.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 -0.8660 -1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1420 -0.0720 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1540 -1.6920 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8310 -2.6170 -2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2660 -0.6610 -2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4640 0.3220 -3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9850 -2.2720 -2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7460 -3.2300 -3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2060 -2.6620 -4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2060 0.8070 -4.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3170 0.1800 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4330 -0.4230 -5.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8890 -3.8550 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7750 -1.1530 -4.0040 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.2660 -1.3410 -4.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 54 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 54 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 54 1 0 0 0 0 26 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END