CHEMDIV-ZINC04906456 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 0.0000 1.4150 1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -0.0670 1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -0.6350 0.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -0.7620 1.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -2.2030 0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 -2.7440 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -4.1850 0.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 -4.8800 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7540 -4.3110 0.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6890 -6.3340 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -6.9900 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -8.3470 -0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -9.0620 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 -8.4180 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8820 -7.0560 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0570 -9.1460 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2100 -8.5740 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4160 -9.1110 -0.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4870 -8.2650 -0.9230 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.7750 -7.5730 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7460 -8.8780 -1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3670 -7.5350 -2.6340 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.4440 -8.0140 -3.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4990 -6.9200 -2.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8980 -6.4240 -2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8520 -7.4490 -2.1070 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.6450 -8.1040 -2.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3320 -6.9700 -1.2660 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 1.8000 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 1.9170 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 1.5990 2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 -0.3080 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -2.3870 -0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 -2.7050 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9810 -2.5600 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 -2.2420 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 -4.6390 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -6.4340 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -8.8520 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 -10.1240 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8180 -6.5550 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0730 -10.0540 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4990 -9.7670 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4770 -9.1120 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6620 -5.9320 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0430 -5.6960 -1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 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 28 1 0 0 0 0 M END