IBS-ZINC05219349 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 1.7990 1.0820 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -0.3200 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -0.9900 1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -2.3010 1.8750 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -3.4380 2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 -4.6050 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -4.6550 1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 -3.5640 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -2.3280 1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -1.1530 0.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -0.5270 2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -1.2620 3.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 0.8760 3.2820 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2620 1.3680 3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 2.1240 5.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 2.7410 5.8990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 1.9790 5.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 1.0680 4.3840 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9080 1.6020 3.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -0.1940 5.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -1.0340 5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -2.1950 6.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -2.5240 6.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 -1.7120 5.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 -0.5490 4.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 -3.6400 6.8310 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 2.6500 6.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 1.9390 7.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 2.2190 10.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 3.1420 8.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 1.2750 3.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 1.7600 1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 1.1990 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 1.3800 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -3.3480 3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -5.5100 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -5.6050 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 -3.6010 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -0.8050 5.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -2.8490 6.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 -1.9920 5.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6060 0.0680 4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 2.7360 6.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 3.6640 6.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 1.6830 7.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 1.0220 7.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 1.2610 10.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 2.0870 10.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 2.9170 11.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 3.7060 7.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 2.2050 8.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2760 3.7610 9.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 1.5980 2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 2.8210 8.9110 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0550 3.7130 8.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 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 18 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 31 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 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 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 54 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 54 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 54 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END