PUBCHEM-ZINC06350967 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 0.0740 1.2840 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.2250 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -0.7380 0.2120 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0080 -1.1420 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 -1.1670 -2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 -1.6370 -3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 -2.0590 -2.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2430 -2.0320 -1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 -1.5630 -0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 -1.3800 0.8300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -0.9130 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 -0.7340 2.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -0.3560 3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 -1.1310 2.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -1.5250 1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4930 -2.0650 1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4640 -1.0310 1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6080 -1.8220 0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6630 -1.7720 -0.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7110 -1.1040 4.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -1.6580 5.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 -1.6240 6.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3040 -1.0340 7.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1880 -0.4750 6.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 -0.5050 4.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 1.6600 0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 1.5920 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 1.7600 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -0.6960 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -0.5180 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -0.8410 -2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -1.6770 -4.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -2.4120 -3.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2290 -2.3530 -1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 -2.9810 1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8320 -2.3850 2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8480 -0.3790 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0030 -0.3880 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -2.1350 5.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -2.0630 7.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 -1.0110 8.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1100 -0.0130 6.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5970 -0.0460 4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3240 -2.4460 1.5020 O 0 5 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 3 11 2 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 44 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 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M CHG 1 3 1 M CHG 1 44 -1 M END