IBS-ZINC00305713 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8150 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -2.5530 0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -2.3880 2.5190 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5600 -2.0380 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -1.9350 3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -2.4890 5.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -4.0200 4.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 -4.4610 3.6770 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -3.9180 2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3370 -5.5490 3.6120 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 -5.3520 2.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 -5.4530 4.8550 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 -7.1580 3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 -7.9410 2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -9.2170 2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -9.7170 3.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -8.9380 4.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 -7.6420 4.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 -6.8980 5.7550 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -7.3450 6.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 -8.6110 6.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -9.4180 5.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -0.8460 3.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -2.3050 3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 -2.1390 5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -2.1460 5.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -4.4190 5.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -4.3750 5.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -4.2650 2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -4.2490 1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -7.5660 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 -9.8170 1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -10.7070 3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -6.7140 7.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -8.9500 7.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -10.4020 5.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 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 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END