PUBCHEM-ZINC05973457 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 75 0 0 1 0 0 0 0 0999 V2000 0.5090 0.7170 -1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -0.6910 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -0.9000 0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -2.3150 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -1.7350 3.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -0.6480 3.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 0.2380 5.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.3190 5.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -4.0540 2.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 -4.4250 3.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -5.3390 4.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 -5.7240 5.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 -5.2100 5.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 -4.2970 4.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7640 -3.9190 3.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9780 -3.0180 2.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7240 -5.5640 6.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4730 -6.7700 7.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 -6.6630 7.8770 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0260 -5.6850 8.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -6.7520 6.7540 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1230 -7.7290 6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -6.7410 7.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -7.7380 8.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -7.5780 9.5810 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8160 -7.7700 8.8970 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8010 -8.7210 8.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 -7.9970 10.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 -8.9800 10.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 -8.6860 10.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -9.2540 11.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -6.2660 10.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 0.9170 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 0.8440 -2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 1.4640 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -0.8700 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -1.4140 -1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -0.7200 0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -0.1620 1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -2.5050 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -3.0410 0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -2.3970 4.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -1.3160 3.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -1.1080 4.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -0.0290 3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 0.7110 4.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -0.3730 5.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 0.8800 5.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 1.9690 4.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 1.9410 6.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -4.5990 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -4.3230 3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -5.7610 4.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7990 -3.8910 4.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 -2.8520 2.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6160 -5.7620 5.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9420 -4.6900 6.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 -7.6960 6.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2590 -6.8100 8.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -5.7270 7.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -6.9940 6.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -7.6000 8.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -8.7610 8.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7340 -8.4270 9.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -7.0660 10.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 -10.0160 10.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 -8.8020 12.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -6.2530 10.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 -6.1460 11.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 -5.3780 9.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -2.5680 2.4310 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3300 -2.3530 2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 4 71 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 71 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 51 1 0 0 0 0 9 52 1 0 0 0 0 9 71 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 56 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 24 25 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 25 32 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 29 30 1 0 0 0 0 29 66 1 0 0 0 0 29 67 1 0 0 0 0 30 31 2 0 0 0 0 32 68 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 71 72 1 0 0 0 0 M CHG 1 71 1 M END