CHEMDIV-ZINC06720931 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1110 -2.6900 0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7970 -4.4240 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -5.3290 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 -6.7220 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -7.4400 -0.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -7.3040 0.3660 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -6.5640 0.9100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4660 -7.1730 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 -5.0250 -0.0210 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 -6.2440 2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 -6.1340 3.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -5.8410 4.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -5.6540 5.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -5.7650 4.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -6.0540 2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -5.3390 6.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -5.2430 7.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2010 -4.8260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2650 -4.4270 -0.0080 N 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 -8.2620 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -6.2800 2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -5.7560 5.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1790 -5.6220 4.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 -6.1370 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6140 -5.1590 6.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 -4.9560 7.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 22 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 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 22 23 3 0 0 0 0 38 39 1 0 0 0 0 M END