IBS-ZINC05322935 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -0.1090 1.4620 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 0.0410 -0.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 -0.5810 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 0.0720 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 -0.6470 0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -2.0410 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 -2.6860 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -1.9950 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -2.9790 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -4.2390 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 -4.0280 0.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -4.7470 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -5.5100 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -5.5960 0.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -6.6330 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -7.9720 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -9.0050 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -10.4110 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -9.7300 -1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -8.3230 -1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -12.1600 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -12.6350 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -12.7750 -3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -13.1810 -4.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -13.4550 -5.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -13.3240 -4.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -12.9160 -3.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 1.7910 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 1.8260 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 1.8920 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 1.1540 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6450 -0.1110 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -2.5920 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -2.7820 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 -6.5340 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -7.9790 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 -8.7740 1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -8.9560 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -10.5260 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -11.1470 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -9.9870 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -9.8360 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -8.2330 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -7.6110 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -12.7850 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -12.2400 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 -12.5660 -2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -13.2830 -5.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -13.7740 -6.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 -13.5430 -5.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -12.8280 -2.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -10.7180 -1.0400 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1620 -10.6360 -1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 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 35 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 52 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 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 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END