OTAVA-ZINC05235965 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 0 0 0 0 0999 V2000 -0.0390 1.2760 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 0.0110 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -0.6370 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 -0.0230 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 1.2600 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 1.9010 0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 1.5990 1.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 2.4250 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 0.5450 0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -0.4020 0.1470 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8910 0.4860 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5660 -0.6120 0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0180 -0.8580 0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8060 -0.0480 0.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3980 -2.0260 -0.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4800 -2.8710 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7710 -4.4190 -1.2380 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 -2.0870 -0.3720 S 0 0 0 0 0 0 0 0 0 0 0 0 9.7550 -2.3760 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3130 -3.0460 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6500 -3.3910 0.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4340 -3.0680 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8810 -2.4010 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5430 -2.0590 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8930 -3.4460 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0500 -4.8160 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0780 -5.4230 -1.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 1.7770 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -0.4660 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -1.6210 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 2.8860 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4290 1.3160 1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7020 -3.2980 1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0850 -3.9120 1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4950 -2.1500 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1110 -1.5420 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4490 -2.7190 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2780 -3.4540 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2710 -5.3610 -0.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3220 -6.2410 -1.2740 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 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 26 27 2 0 0 0 0 26 39 1 0 0 0 0 39 40 1 0 0 0 0 M END