IFLAB-ZINC04315385 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.1300 0.5700 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 0.6240 -0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 0.8000 -1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 0.9190 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 0.8610 0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 0.6880 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 1.0060 0.8940 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 1.0130 1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 1.1400 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 1.0920 -1.3230 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7850 1.3060 -0.2070 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1890 0.6840 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 2.7660 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6780 2.9610 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2630 2.4740 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3920 0.8200 -1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5140 0.4430 -2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0020 0.2430 -2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5240 -0.7880 -1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9050 -0.9630 -1.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7910 -0.1100 -2.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2690 0.9100 -3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8880 1.0870 -3.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2790 -0.3140 -2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7500 -1.1830 -3.2710 F 0 0 0 0 0 0 0 0 0 0 0 0 14.9870 0.8370 -2.4980 F 0 0 0 0 0 0 0 0 0 0 0 0 14.6550 -0.8170 -1.1290 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 0.4330 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 0.5300 -1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 0.8430 -2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 0.6460 2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6870 3.4230 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7970 3.0840 1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9150 4.0220 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1470 2.4220 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8780 3.0460 -2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3540 2.5450 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 -0.2530 -1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 1.3620 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2440 1.1040 -3.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0400 -0.5300 -2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8650 -1.4730 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2880 -1.7740 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9390 1.5760 -3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5180 1.8910 -4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8930 1.0240 -1.5320 N 0 3 0 0 0 0 0 0 0 0 0 0 8.2830 0.4870 -0.7470 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 46 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 46 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 46 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 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END