IBS-ZINC02093825 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 0.0050 1.4790 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.0270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -0.7500 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.1310 1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -2.7900 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.0670 -1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6860 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -4.5510 -0.1240 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -4.9070 -1.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -4.9740 1.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -5.0750 -0.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -4.7670 -1.1810 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7790 -4.6060 -2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 -3.5020 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -5.9190 -1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2310 -6.8960 -0.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2360 -5.8590 -2.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 -6.9700 -2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0320 -7.2640 -1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8000 -8.3760 -1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5430 -9.2280 -2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4960 -8.9350 -3.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 -7.7980 -3.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -9.7600 -4.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9900 -10.8610 -5.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7330 -11.5730 -6.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0550 -11.2190 -4.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3500 -10.4310 -3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5160 -11.0030 -2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6290 -12.4690 -2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0010 -12.4000 -4.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 1.8640 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 1.8550 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 1.8080 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -0.2350 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -2.6960 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.5820 -2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.1210 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -5.5850 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -2.6690 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -3.2740 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 -3.6630 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2300 -6.6070 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6040 -8.6000 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 -7.5600 -4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3160 -10.9670 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4300 -10.4570 -2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0580 -13.1330 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6720 -12.7810 -2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7730 -12.2360 -5.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4510 -13.3160 -4.4810 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 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 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 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 M END