NCID-ZINC06002214 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 69 0 0 1 0 0 0 0 0999 V2000 0.5000 2.1200 -0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 0.8780 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 0.0000 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 0.3410 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 1.5990 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 2.4680 -0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 3.6820 -1.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1460 2.0330 -0.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 -0.7940 0.2880 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -2.2490 -0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -3.3850 -0.7010 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6300 -3.7010 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 -4.5430 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 -4.5250 -2.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -5.5480 -0.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -6.6980 -1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 -7.7800 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -7.4800 1.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5160 -3.0620 -1.4960 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7940 -3.3450 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0750 -3.8020 0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8360 -3.0700 -2.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2370 -3.4970 -1.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2460 -3.4760 -2.8310 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2150 -2.5420 -3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6980 -3.7340 -2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1460 -4.7540 -2.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 0.4740 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -0.6830 -0.7990 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9000 -1.2920 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -1.5530 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 -1.3350 0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 -0.2010 -1.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 -0.2240 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 0.2060 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 0.2180 -3.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 0.6250 -4.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 1.0150 -5.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 2.8130 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -0.9570 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 3.6670 -1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 1.3370 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -2.6140 -0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0430 -1.9240 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -5.5780 0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -6.3400 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -7.1140 -1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3680 -2.6620 -2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5350 -3.6140 -3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8250 -1.9990 -2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5670 -2.8260 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2080 -4.5010 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 0.2250 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 1.3470 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 -0.2110 -4.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 1.4670 -3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 1.9080 -5.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 0.2030 -5.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 -8.8360 -0.3540 O 0 5 0 0 0 0 0 0 0 0 0 0 12.1950 -2.9740 -1.4900 O 0 5 0 0 0 0 0 0 0 0 0 0 9.9400 -4.5940 -3.8150 N 0 3 0 0 0 0 0 0 0 0 0 0 9.7830 -4.2840 -4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2610 -5.2930 -3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9010 -5.0740 -3.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -2.3510 0.8830 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.6140 1.3340 -6.3780 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2390 1.6140 -7.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 2.1030 -6.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2220 0.5190 -6.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 39 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 59 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 61 1 0 0 0 0 26 27 2 0 0 0 0 26 60 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 33 1 0 0 0 0 31 32 2 0 0 0 0 31 65 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 38 1 0 0 0 0 37 55 1 0 0 0 0 37 56 1 0 0 0 0 38 57 1 0 0 0 0 38 58 1 0 0 0 0 38 66 1 0 0 0 0 61 62 1 0 0 0 0 61 63 1 0 0 0 0 61 64 1 0 0 0 0 66 67 1 0 0 0 0 66 68 1 0 0 0 0 66 69 1 0 0 0 0 M CHG 1 59 -1 M CHG 1 60 -1 M CHG 1 61 1 M CHG 1 65 -1 M CHG 1 66 1 M END