IFLAB-ZINC04315351 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 -0.0050 -0.0140 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 0.3510 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 0.7090 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 0.6920 -0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 0.3240 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.0360 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 0.4130 0.8210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 0.2150 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4050 0.8180 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 0.9920 -1.3210 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8840 1.0110 -0.1900 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3120 0.2300 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2300 2.3810 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7350 2.6330 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3090 2.4840 -1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4850 0.8600 -1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6420 0.8340 -2.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0720 0.3480 -2.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 -0.0430 -1.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8530 0.3950 -3.8170 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2060 0.0020 -3.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9800 -0.5090 -2.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3130 -0.8720 -3.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8810 -0.7280 -4.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1190 -0.2190 -5.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7950 0.1390 -5.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0630 0.6300 -6.2150 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -0.2880 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 0.3580 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 0.9930 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -0.3190 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7210 3.1770 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8670 2.4490 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9440 3.6410 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2340 1.9300 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8890 3.2230 -1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4000 2.5780 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 -0.1610 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 1.5690 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6040 1.7480 -3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0860 0.0320 -3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4520 0.7430 -4.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5820 -0.6400 -1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9120 -1.2710 -2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9170 -1.0140 -4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5460 -0.1020 -6.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9710 1.1130 -1.5540 N 0 3 0 0 0 0 0 0 0 0 0 0 8.4110 0.4260 -0.9130 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 47 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 47 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 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END