IBS-ZINC03859927 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -2.7560 -5.9660 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 -5.7760 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -5.2570 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -4.7370 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -4.7800 -2.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -4.2660 -2.4920 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4570 -4.6940 -3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 -2.7170 -2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 -2.2060 -1.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1530 -2.2730 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0880 -1.7390 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 -0.8490 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 0.1300 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 0.9550 1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 0.8250 2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 -0.1120 2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7400 -0.9290 1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8890 -1.8580 1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3740 -2.2060 2.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3070 -2.2970 0.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4910 -2.1920 -1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8290 -2.4290 -2.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6270 -2.8920 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9180 -3.8640 -0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1970 -4.4230 -1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2170 -4.0210 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9550 -3.0620 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6750 -2.5070 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -6.3900 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -5.0150 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 -6.6500 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 -6.7110 -1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 -5.3740 -1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -6.3520 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -4.8590 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 -3.7100 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -5.3470 -1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -4.1870 -3.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -5.8150 -3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -2.2690 -2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -2.3710 -3.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -1.7010 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 -2.8940 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 0.2950 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 1.7100 1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 1.4710 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 -0.1860 3.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1550 -4.2360 -1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3950 -5.1760 -1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2100 -4.4520 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7460 -2.7380 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5330 -1.7420 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -4.7790 -1.0910 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4660 -3.9240 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 53 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 21 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 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END