PUBCHEM-ZINC04172316 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 71 0 0 1 0 0 0 0 0999 V2000 0.5260 1.5780 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 0.0770 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -0.3670 0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -1.8640 1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -2.7450 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 -4.1250 0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -4.6440 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -3.7870 2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 -2.4010 1.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -1.5270 2.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -4.2980 2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 -3.4740 3.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -5.7740 2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 -2.1590 0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9100 -3.0100 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 -2.1180 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 -2.9330 -1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0670 -2.0280 -2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1890 -2.8310 -3.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0820 -1.9020 -3.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1890 -2.3980 -4.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4810 -3.7600 -4.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6080 -4.1900 -5.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4750 -3.2660 -5.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1840 -1.9010 -5.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0600 -1.4680 -5.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8530 -0.0050 -4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0770 0.7120 -5.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4080 0.5810 -3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6890 -3.7260 -6.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0260 -5.1670 -6.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7500 -6.0020 -6.3400 C 0 0 3 0 0 0 0 0 0 0 0 0 12.2770 -5.9170 -7.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8040 -5.5450 -5.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0060 -7.5080 -6.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1060 -7.8120 -5.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 1.8800 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 1.8750 -1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 2.1270 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -0.1960 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -0.4400 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -0.0720 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 0.1660 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -4.8300 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -5.7220 1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -2.0680 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -6.1660 3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 -5.9480 3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -6.2960 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 -3.5900 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 -3.6830 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 -1.5020 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3550 -1.4120 -0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5560 -3.5370 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6190 -3.6290 -2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5700 -1.4130 -3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4990 -1.3210 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7170 -3.4090 -2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7640 -3.5030 -3.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8470 -4.5260 -4.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8440 -1.1700 -6.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9230 1.5340 -3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3290 0.7520 -3.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6770 -0.0670 -2.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4840 -3.6450 -7.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5480 -3.0850 -6.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7830 -5.5570 -6.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4550 -5.1900 -5.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0810 -8.2790 -6.4820 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 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 14 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 7 8 2 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 10 46 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 20 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 60 1 0 0 0 0 23 24 1 0 0 0 0 23 34 1 0 0 0 0 24 25 2 0 0 0 0 24 30 1 0 0 0 0 25 26 1 0 0 0 0 25 61 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 30 31 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 31 32 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 35 36 2 0 0 0 0 35 69 1 0 0 0 0 M CHG 1 69 -1 M END