IBS-ZINC02131424 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.6780 1.6110 -1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 0.3800 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 0.7260 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -0.3330 -0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -1.6580 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -2.3890 -0.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 -2.1470 -0.1810 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4420 -1.8030 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -0.5120 1.5660 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 -0.1210 2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 0.3040 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 1.4840 1.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -2.6250 1.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 -3.6410 -0.5170 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6100 -3.9160 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -4.0600 -0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2230 -5.1960 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5540 -5.2300 -0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6460 -6.1030 -0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8610 -5.8390 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9850 -4.7150 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9110 -3.8340 -2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7110 -4.1150 -1.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5110 -3.4340 -1.6010 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3490 -2.5990 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8410 -6.7610 -0.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1090 -6.5390 -1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 -6.1480 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9940 -5.9640 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 2.0240 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 1.3480 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 2.4090 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -0.2950 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -0.1690 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 1.1420 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 1.4630 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -1.5570 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5550 -6.9810 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9150 -4.4900 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0180 -2.9640 -2.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5510 -5.5970 -1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0370 -6.5690 -2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7740 -7.3500 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 -5.9620 1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7760 -7.1830 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 -6.4720 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -6.3230 -0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -4.5010 0.6130 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6170 -4.3910 0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0410 -4.1360 1.5030 H 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 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 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 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 48 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 48 1 M END