PUBCHEM-ZINC02951709 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 0.0410 1.4050 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 0.0180 0.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -0.4680 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 0.2770 -1.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -0.3380 -2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -1.7020 -3.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 -2.3840 -4.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 -3.6950 -4.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -4.4840 -3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -5.7600 -3.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -6.4120 -2.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -6.5090 -3.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -7.1450 -2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -7.7100 -0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -7.6240 -0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -6.9880 -1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1830 -8.4000 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -8.4410 -0.1330 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7950 -3.8040 -2.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 -2.4290 -2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -1.8340 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -4.2760 -5.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6130 -3.5580 -6.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -5.6300 -5.8950 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2230 -6.4610 -6.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0550 -6.0180 -7.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 -6.9100 -8.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 -8.2520 -8.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 -8.7050 -7.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -7.8140 -6.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 1.6580 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 2.0160 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 1.6260 1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 1.3410 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 0.2640 -3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0230 -1.7790 -4.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -6.0810 -3.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -7.2030 -2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -8.0600 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -6.9370 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -2.4300 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 -6.0880 -5.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3670 -4.9810 -8.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 -6.5520 -9.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 -8.9430 -9.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 -9.7520 -7.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 -8.1920 -6.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 -8.8930 1.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 21 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 20 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 48 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 M CHG 1 18 -1 M END