IBS-ZINC06645536 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -0.7570 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -2.1560 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -2.8540 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 -2.1750 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -0.7910 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -0.0780 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1560 -3.0760 0.0330 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.1450 -2.2050 -0.4980 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8660 -4.3520 -0.5210 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 -3.3360 1.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3940 -2.3680 2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5920 -3.1040 2.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0890 -4.2690 3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3130 -5.2520 2.9290 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9600 -5.6150 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 -4.5430 2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8460 -6.4160 3.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 -6.6540 3.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -2.6870 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -3.9340 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6100 -0.2680 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 1.0020 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8070 -1.9070 3.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7480 -1.6000 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1640 -2.4160 3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2270 -3.4870 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4340 -3.8880 4.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9380 -4.7800 4.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6090 -5.2100 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 -4.2630 3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7420 -7.1870 4.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3960 -7.9210 4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 9 2 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 37 38 1 0 0 0 0 M END