IBS-ZINC02355167 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.0580 0.9610 0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -0.2160 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -0.9150 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -2.0950 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -2.7420 -0.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -3.7250 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 -4.1130 0.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4740 -4.2420 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2480 -4.4710 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4960 -4.9300 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4910 -5.2580 1.6770 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1800 -5.0840 2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1380 -5.3960 3.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8860 -5.2350 5.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6530 -4.7530 5.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6810 -4.4390 4.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9200 -4.5960 3.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9460 -4.2790 2.5290 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4950 -5.0600 -0.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 -4.5710 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9800 -4.4440 -2.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5570 -5.6180 -1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8910 -5.4270 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9170 -5.9840 -1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6170 -6.7420 -2.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2850 -6.9630 -3.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2620 -6.4000 -2.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9450 -7.7940 -4.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7250 -7.8160 -4.8010 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0210 1.4460 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 1.7070 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 0.6320 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 0.1410 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.9270 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -1.2630 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -0.2010 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -1.7570 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -2.8310 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 -2.4610 -1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1040 -5.7760 3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6520 -5.4860 6.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4420 -4.6230 6.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7140 -4.0650 5.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0430 -4.2450 -2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6700 -4.5570 -3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1630 -4.8250 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9530 -5.8240 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4240 -7.1740 -3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2330 -6.6370 -2.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9030 -8.4010 -5.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 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 20 2 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 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 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 2 0 0 0 0 M CHG 1 29 -1 M END