NCID-ZINC06005083 MOE2007 3D CORINA 3.40 0006 02.08.2006 88 91 0 0 1 0 0 0 0 0999 V2000 -0.1760 1.8910 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 0.3680 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -0.0030 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -0.1870 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -0.1980 -1.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 0.1900 -1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 0.9810 -0.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 -0.2980 -2.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 0.1250 -2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 -0.5710 -3.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0120 -0.1300 -4.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5960 -0.8260 -5.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0480 -0.3850 -5.6000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0940 0.7040 -5.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5810 -0.9630 -6.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1930 -2.0100 -6.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3760 -0.3170 -8.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7410 1.0050 -8.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1910 1.0180 -9.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2990 0.2450 -10.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7550 -0.8120 -9.3820 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2550 -1.7600 -9.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2500 -0.9920 -9.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9400 -0.7330 -8.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8190 -1.4390 -10.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2720 -1.6140 -10.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6500 -2.1210 -12.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7900 -2.3170 -12.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9430 -2.3560 -12.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8580 -0.8620 -4.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9950 -0.2180 -4.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3470 0.7580 -4.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7400 -0.6570 -3.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9510 0.0850 -2.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6590 -0.5570 -1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8540 0.2720 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9720 1.5730 -0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2180 2.0910 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3480 1.3050 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2390 0.0010 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9850 -0.5280 -1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5840 -1.8720 -1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2020 -1.9120 -2.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5880 -3.0630 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3450 -4.1860 -2.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7180 -4.1560 -2.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3410 -3.0080 -2.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 2.2860 -0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 2.1550 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 2.3160 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 0.4220 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -1.0880 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 0.3930 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 0.0770 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.2720 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 0.2380 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -0.9290 -3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 1.2050 -2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -0.1440 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5250 -1.6510 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0 0 0 0 0 0 0 0 0 0 13.0910 2.1890 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3080 3.1110 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3190 1.7130 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1240 -0.6100 -1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5160 -3.0890 -2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8620 -5.0870 -3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3050 -5.0350 -2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4140 -2.9890 -2.0030 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 5 1 0 0 0 0 3 51 1 0 0 0 0 3 52 1 0 0 0 0 3 53 1 0 0 0 0 4 54 1 0 0 0 0 4 55 1 0 0 0 0 4 56 1 0 0 0 0 5 6 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 57 1 0 0 0 0 9 10 1 0 0 0 0 9 58 1 0 0 0 0 9 59 1 0 0 0 0 10 11 1 0 0 0 0 10 60 1 0 0 0 0 10 61 1 0 0 0 0 11 12 1 0 0 0 0 11 62 1 0 0 0 0 11 63 1 0 0 0 0 12 13 1 0 0 0 0 12 64 1 0 0 0 0 12 65 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 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