IBS-ZINC02285877 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.2730 1.5790 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 0.0860 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -0.5230 0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -1.9170 0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -2.7520 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -2.1160 -1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -0.7210 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -4.1630 0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -4.9020 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -6.1740 -1.0830 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1150 -5.8940 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -7.0260 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -6.2270 1.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -4.8540 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -4.4170 2.4570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -5.5270 3.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -6.6590 2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -7.9580 3.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -8.9700 2.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -7.9410 4.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -6.7870 5.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -6.8590 6.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -5.5570 4.6120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -4.3220 5.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -9.2380 5.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -9.8770 5.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -11.2800 5.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -11.7340 6.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -6.9060 -2.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 -7.6480 -2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 1.8860 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 1.9720 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 2.0310 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 0.0760 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -2.3460 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -2.6980 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -0.2730 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -4.2970 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -5.1550 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -7.8210 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -7.4970 -0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -3.6500 5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -4.4970 6.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -3.8520 4.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -9.1080 6.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -9.8870 4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -9.9470 4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 -9.2560 5.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 -11.8240 5.8840 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 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 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 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 25 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 49 -1 M END