NCID-ZINC05545411 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 77 0 0 1 0 0 0 0 0999 V2000 1.1060 0.6650 2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -0.8470 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -1.1330 1.8750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -2.6270 1.6040 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -3.4590 2.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 -2.5780 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -2.1010 2.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -1.9710 2.4020 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4310 -0.8960 3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1450 0.2770 3.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3280 -1.6180 4.3460 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9230 -1.5270 5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3680 -3.0250 3.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6170 -3.2510 2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4770 -4.3320 2.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1340 -4.0570 4.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1880 -5.0760 5.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 -4.9090 6.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 -5.8430 7.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4520 -6.9440 6.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 -7.1110 5.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8170 -6.1790 4.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7370 -1.0220 4.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5880 -1.6330 5.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9290 -0.9000 5.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7810 -1.5120 6.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0640 -0.8100 6.6770 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.9820 -1.1790 7.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7450 -2.0940 8.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.1620 -0.5340 7.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.1030 -0.9860 8.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4730 -0.8380 10.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3760 -0.1400 8.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4510 -2.4550 8.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 -1.8220 3.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -3.2610 0.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -3.5300 0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -4.1270 -0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 0.8830 2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 1.1580 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 1.0300 3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -1.2120 1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -1.3400 3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 -1.8960 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -3.5770 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7120 -3.5980 5.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8100 -4.5480 3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 -4.0490 7.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4420 -5.7130 8.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 -7.6740 6.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 -7.9710 4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2050 -6.3120 3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6790 0.0580 4.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1910 -1.2420 3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7620 -2.6880 5.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0650 -1.5360 6.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7550 0.1540 5.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4520 -0.9970 4.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9550 -2.5660 6.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2580 -1.4150 7.5550 H 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