PUBCHEM-ZINC06015118 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 68 0 0 0 0 0 0 0 0999 V2000 -0.0080 0.7220 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -0.7830 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -1.5230 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -1.0760 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -0.4650 -1.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 -0.5930 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -1.5760 -3.5520 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 0.0520 -2.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1150 0.0040 -3.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7490 1.1690 -4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4340 2.3460 -6.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3660 2.2790 -7.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0710 1.1020 -8.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 -0.1110 -7.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2760 -0.0680 -6.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7310 0.8030 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 2.2540 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 2.7100 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 4.1230 -0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 4.6480 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 5.9840 -0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 6.8140 -1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 6.3060 -1.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 4.9610 -1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 4.4350 -2.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5550 5.0130 -2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 3.1350 -1.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2830 2.7060 -2.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 8.1300 -1.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 8.9240 -2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 6.4980 -0.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 5.5950 0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 1.2500 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 1.0580 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 0.9310 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -1.1190 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 -1.1870 -0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -2.5960 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -1.3150 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -2.1540 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -0.6610 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 0.0310 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1650 0.0800 -3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 -0.9390 -3.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 1.0920 -4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 2.1110 -3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 3.2110 -5.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 2.4360 -6.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 3.1600 -8.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4020 2.2440 -7.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9460 -0.9590 -8.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2410 -0.2150 -7.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -0.0180 -6.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 -0.9660 -5.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 0.4000 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8130 0.7140 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 2.0420 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 4.0080 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1400 6.9550 -2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 9.9520 -2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 8.9020 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 8.5250 -3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 4.7950 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 5.1700 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 6.1320 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 1.1200 -5.5880 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 10 66 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 11 66 1 0 0 0 0 12 13 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 15 66 1 0 0 0 0 16 17 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 57 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 58 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 22 23 2 0 0 0 0 22 29 1 0 0 0 0 23 24 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 29 30 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 M END