PUBCHEM-ZINC02981046 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 0 0 0 0 0 0 0 0999 V2000 0.1600 -0.1000 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 2.4030 0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 2.4560 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 2.1860 -1.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 2.2940 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 1.3320 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 2.0780 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 1.5650 -0.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 2.0800 -2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 1.5860 -3.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 0.1610 -3.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -0.3520 -4.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 -0.8690 -4.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -1.4160 -5.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -1.4570 -6.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 -0.9590 -6.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -0.4080 -5.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8150 0.0970 -5.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 0.0040 -7.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -0.7830 -2.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -1.3150 -2.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -0.0840 2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -0.1860 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -0.9300 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 2.3760 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 3.2750 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 3.4470 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 1.7090 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 1.8290 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 0.3200 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 1.9030 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 3.1540 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 1.7200 -1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1110 3.1750 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 2.0590 -4.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 1.8480 -3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -1.8230 -5.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -1.8870 -7.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 -1.0200 -7.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 0.5920 -7.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5540 -1.0400 -7.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4530 0.4250 -7.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -2.3890 -2.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 -0.7730 -3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -1.1790 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 1.1780 0.7950 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6200 1.1320 -0.2450 H 0 0 0 0 0 0 0 0 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 1 46 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 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 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END