PUBCHEM-ZINC06135073 MOE2007 3D CORINA 3.40 0006 02.08.2006 92 94 0 0 1 0 0 0 0 0999 V2000 0.0510 -2.5590 0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 -1.7280 1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 -1.9440 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -0.2460 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.0010 2.4080 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7820 -0.6700 2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -0.2630 3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 0.6640 4.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -1.5280 4.0600 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -1.7800 5.3190 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5550 -1.0020 6.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -3.1440 5.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -3.1140 6.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 -3.4640 5.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 -3.4370 5.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7530 -3.0600 6.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -2.7110 7.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -2.7420 7.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 -1.7700 5.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 -1.5720 3.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -1.9810 6.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 1.3890 2.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 1.7180 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 0.8520 1.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 3.1630 1.7050 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7320 3.6660 2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 3.8440 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 5.3160 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 6.2000 1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 7.5490 1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 8.0160 0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 7.1260 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 5.7790 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 9.3420 0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5350 9.7520 -0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 11.2440 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 12.0820 -1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 13.4520 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 13.9840 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 13.1460 0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5160 11.7760 0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 3.2370 1.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 2.6790 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 2.1130 -0.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 2.7470 0.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 2.1230 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3750 0.6310 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2280 2.3020 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0390 2.7790 -2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -2.1860 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -3.6020 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -2.4810 1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -2.0360 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 -1.6360 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 -1.3520 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 -3.0000 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 0.3550 1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 0.0340 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -2.2730 3.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -3.9110 5.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -3.3700 6.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -3.7580 4.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 -3.7090 4.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -3.0380 7.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -2.4160 8.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -2.4730 8.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 -2.1390 6.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -1.9740 5.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 2.0720 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 3.7120 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 3.3990 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 5.8360 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 8.2390 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 7.4870 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1820 5.0870 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 9.4820 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 9.2540 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 11.6670 -1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 14.1060 -1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 15.0540 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3000 13.5610 1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0230 11.1210 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 3.6890 2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8540 0.1640 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7360 0.1630 -2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2950 0.5040 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4680 3.3660 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5890 1.8340 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7070 1.8350 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 2.6520 -2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4000 2.3110 -3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2790 3.8420 -2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 50 1 0 0 0 0 1 51 1 0 0 0 0 1 52 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 53 1 0 0 0 0 3 54 1 0 0 0 0 3 55 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 57 1 0 0 0 0 4 58 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 59 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 60 1 0 0 0 0 12 61 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 62 1 0 0 0 0 15 16 1 0 0 0 0 15 63 1 0 0 0 0 16 17 2 0 0 0 0 16 64 1 0 0 0 0 17 18 1 0 0 0 0 17 65 1 0 0 0 0 18 66 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 67 1 0 0 0 0 21 68 1 0 0 0 0 22 23 1 0 0 0 0 22 69 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 42 1 0 0 0 0 27 28 1 0 0 0 0 27 70 1 0 0 0 0 27 71 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 72 1 0 0 0 0 30 31 1 0 0 0 0 30 73 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 74 1 0 0 0 0 33 75 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 35 76 1 0 0 0 0 35 77 1 0 0 0 0 36 37 1 0 0 0 0 36 41 2 0 0 0 0 37 38 2 0 0 0 0 37 78 1 0 0 0 0 38 39 1 0 0 0 0 38 79 1 0 0 0 0 39 40 2 0 0 0 0 39 80 1 0 0 0 0 40 41 1 0 0 0 0 40 81 1 0 0 0 0 41 82 1 0 0 0 0 42 43 1 0 0 0 0 42 83 1 0 0 0 0 43 44 2 0 0 0 0 43 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46 49 1 0 0 0 0 47 84 1 0 0 0 0 47 85 1 0 0 0 0 47 86 1 0 0 0 0 48 87 1 0 0 0 0 48 88 1 0 0 0 0 48 89 1 0 0 0 0 49 90 1 0 0 0 0 49 91 1 0 0 0 0 49 92 1 0 0 0 0 M END