PUBCHEM-ZINC05469475 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 77 0 0 0 0 0 0 0 0999 V2000 1.3630 -2.5320 2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -2.0280 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -0.5660 1.2190 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7820 0.0340 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 -0.4190 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 0.0290 -1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -0.5410 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -0.0840 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -0.1900 2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 1.3200 2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 1.7080 3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 3.2190 3.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 3.6060 5.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 5.1170 5.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2310 5.5040 6.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4710 7.0150 6.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2230 7.4020 7.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4630 8.9130 7.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0700 9.3020 8.8950 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.1150 9.0560 9.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7100 9.5360 11.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0080 8.7710 11.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9690 8.9750 10.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2890 8.5160 9.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 10.7310 8.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 11.5480 8.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -2.2210 3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -3.6200 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -2.1130 2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -2.3080 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 -2.4750 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 1.1200 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -0.2840 2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 0.0290 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -1.5050 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 1.1180 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -0.3390 -2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -0.1810 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -1.6300 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -0.4880 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 1.0050 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 -0.7110 2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -0.4680 3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 1.8410 2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 1.6000 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 1.1870 3.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 1.4280 4.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 3.7390 3.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 3.4980 2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 3.0850 5.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 3.3260 5.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 5.6370 5.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 5.3970 4.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1880 4.9830 6.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 5.2240 7.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 7.5350 6.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0650 7.2950 5.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 6.8810 7.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 7.1220 8.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 9.4330 7.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1350 9.1800 6.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 7.9890 10.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 9.5990 9.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 9.3510 12.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9220 10.6030 11.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 7.7100 11.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4660 9.1490 12.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8730 8.3890 10.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2280 10.0310 10.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9710 8.6600 8.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0310 7.4600 9.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1570 10.9060 8.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8130 11.0330 9.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 11.3030 9.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8050 11.3120 7.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3880 12.6110 8.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 50 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 56 1 0 0 0 0 16 57 1 0 0 0 0 17 18 1 0 0 0 0 17 58 1 0 0 0 0 17 59 1 0 0 0 0 18 19 1 0 0 0 0 18 60 1 0 0 0 0 18 61 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 62 1 0 0 0 0 20 63 1 0 0 0 0 21 22 1 0 0 0 0 21 64 1 0 0 0 0 21 65 1 0 0 0 0 22 23 1 0 0 0 0 22 66 1 0 0 0 0 22 67 1 0 0 0 0 23 24 1 0 0 0 0 23 68 1 0 0 0 0 23 69 1 0 0 0 0 24 70 1 0 0 0 0 24 71 1 0 0 0 0 25 26 1 0 0 0 0 25 72 1 0 0 0 0 25 73 1 0 0 0 0 26 74 1 0 0 0 0 26 75 1 0 0 0 0 26 76 1 0 0 0 0 M CHG 1 3 1 M CHG 1 19 1 M END