NCID-ZINC04778076 MOE2007 3D CORINA 3.40 0006 02.08.2006 85 91 0 0 1 0 0 0 0 0999 V2000 0.9780 0.4470 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -0.9450 1.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 -1.5060 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -0.9200 0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 -1.5510 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 -2.9160 -0.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5850 -3.0590 -0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2780 -4.3250 -0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 -5.5010 -0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2650 -6.7030 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2370 -7.6990 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 -7.0530 -0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 -5.7350 -0.5900 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 -5.0460 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 -7.6090 -0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 -6.8990 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -5.6460 0.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -5.4860 0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -4.3710 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -3.0940 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -1.9390 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 -1.7400 2.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -0.8270 2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -0.4770 2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 -1.3440 3.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -2.8140 0.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -3.4810 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -6.7660 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -7.6900 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -9.1250 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 -7.0280 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -7.4320 2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 -8.2590 2.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9060 -8.5430 1.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3720 -9.1170 -1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6840 -6.8950 -1.7010 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8850 -6.4680 -2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4680 -8.1320 -1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8130 -6.8270 -0.6890 C 0 0 3 0 0 0 0 0 0 0 0 0 9.7170 -6.3290 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-1.3230 3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 0.1070 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 -1.3110 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -9.7370 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -9.4740 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -9.3210 -1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 -6.1580 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -7.8120 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -8.0380 2.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -6.5350 3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 -9.7570 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 -9.4850 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1610 -9.2310 -2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0190 -8.9050 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1580 -8.5160 -2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6330 0.9000 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7960 2.1540 -1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5240 -2.3970 -2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6370 -0.6960 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3890 -1.8740 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 0.6440 2.6170 O 0 5 0 0 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65 1 0 0 0 0 30 66 1 0 0 0 0 31 32 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 32 33 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 33 34 2 0 0 0 0 33 82 1 0 0 0 0 35 71 1 0 0 0 0 35 72 1 0 0 0 0 35 73 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 38 39 1 0 0 0 0 38 74 1 0 0 0 0 38 75 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 41 42 2 0 0 0 0 41 83 1 0 0 0 0 43 44 2 0 0 0 0 43 52 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 45 48 1 0 0 0 0 47 48 1 0 0 0 0 47 76 1 0 0 0 0 47 77 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 50 51 2 0 0 0 0 50 85 1 0 0 0 0 52 78 1 0 0 0 0 52 79 1 0 0 0 0 52 80 1 0 0 0 0 83 84 1 0 0 0 0 M CHG 1 81 -1 M CHG 1 82 -1 M CHG 1 85 -1 M END