IBS-ZINC04844065 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 0.7930 2.9930 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 3.3820 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 2.8280 1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 1.8730 0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 1.4970 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 2.0550 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6980 1.3110 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 2.0250 1.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7520 -0.0170 0.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 -0.7320 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8690 -2.0460 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 -2.8970 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 -3.3470 -1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -4.1580 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -4.5210 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -4.0830 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 -3.2700 1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -5.3050 -0.1150 F 0 0 0 0 0 0 0 0 0 0 0 0 7.2180 -0.0640 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4470 0.6490 -1.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1260 -0.3930 0.8590 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5080 0.0560 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4480 -1.0830 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9170 -0.6640 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9270 -1.7760 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4400 -2.8930 -0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 3.4280 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 4.1210 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 3.1410 2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 0.7970 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 1.7680 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 -0.5320 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7770 -2.5570 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 -3.0690 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -4.5110 -2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 -4.3800 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5410 -2.9360 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8260 -0.9730 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6180 0.9020 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7360 0.4050 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2800 -1.9390 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2020 -1.4270 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0920 0.1610 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1470 -0.2940 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1400 -1.4280 0.2930 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 M CHG 1 45 -1 M END