NCID-ZINC05431577 MOE2007 3D CORINA 3.40 0006 02.08.2006 88 90 0 0 1 0 0 0 0 0999 V2000 -0.9450 2.8860 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 1.3790 -1.2410 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2110 1.1600 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 0.6420 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5040 0.8920 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 -0.8680 -0.2480 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7610 -1.1260 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -1.2590 -1.5630 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1720 -2.3230 -1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -0.4490 -2.7080 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6940 -0.6920 -2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 0.9460 -2.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -0.7760 -3.9600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -0.8060 -5.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -1.1180 -6.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 -1.1340 -7.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -1.4630 -8.5490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -1.6350 -7.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 -1.4320 -6.7120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -1.5560 -9.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -0.8560 -7.4580 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 -0.5690 -6.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 -0.5470 -5.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -0.9820 -1.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -1.5660 0.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 1.0410 1.1800 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 2.1540 1.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 2.8250 1.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 2.5640 3.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 3.7970 3.6230 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 4.3540 4.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 3.8350 5.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 5.6230 5.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 6.0390 6.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 7.3270 7.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 7.7440 8.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 9.0310 8.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 9.4480 10.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 10.7360 10.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 11.1520 12.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 12.4400 12.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 12.8500 13.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 13.0950 14.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 13.1320 14.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 14.4550 15.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 14.5200 16.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 14.5470 15.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 3.1050 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 3.4100 -1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 3.2160 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -0.9710 -3.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -1.9010 -8.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -0.3470 -6.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -1.2060 -2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -2.5280 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 0.5040 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 2.7350 2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 1.7740 3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 4.2130 3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 5.4520 5.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 6.4130 4.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 6.2100 6.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 5.2480 7.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 7.1560 7.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 8.1180 6.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 7.9140 8.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 6.9530 9.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 8.8610 9.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 9.8220 8.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 9.6180 9.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 8.6570 10.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 10.5650 10.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 11.5260 10.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 11.3230 11.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 10.3610 12.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 12.2690 12.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 13.2310 11.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 12.9430 13.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 13.2700 15.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 12.3030 15.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 13.0460 13.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 15.2860 14.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 13.6900 17.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 15.4630 17.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 14.4550 17.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 14.5010 14.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 15.4900 15.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 13.7170 15.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 18 52 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 24 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 27 29 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