NCID-ZINC05544800 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 51 0 0 1 0 0 0 0 0999 V2000 -0.0210 1.5460 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 0.0390 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -0.5610 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -0.6380 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -2.0870 -0.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1820 -2.3980 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -2.6000 -1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -2.1430 -2.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -2.4850 -3.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -1.9670 -4.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -2.3320 -5.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -1.8970 -6.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -3.1750 -6.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -3.4390 -6.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -3.6560 -5.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -3.3210 -4.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -4.5100 -5.9550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -1.0440 -3.3960 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3010 -0.8160 -2.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 -0.5140 -4.0130 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3100 -2.6650 0.7030 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2040 -3.7470 0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -2.0570 2.1030 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5130 -0.9750 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 -2.6350 2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 -4.0620 2.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -2.3720 2.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -1.4850 3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 -0.4800 3.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -1.7440 4.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -2.3500 -0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5300 -3.2220 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 -4.2150 0.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8100 -2.9620 -0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.9130 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 1.9050 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 1.9090 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -3.6890 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -2.2150 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -1.6010 -1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -4.7660 -6.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -4.8580 -5.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -2.2700 3.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 -2.3240 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 -4.4970 3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -2.6920 4.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -0.9390 4.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -1.7890 5.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7240 -2.0260 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9950 -3.7800 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6380 -2.8920 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 31 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 27 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 49 1 0 0 0 0 34 50 1 0 0 0 0 34 51 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END