PUBCHEM-ZINC04925807 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 1 0 0 0 0 0999 V2000 -0.0020 1.7920 0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 0.4710 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -0.3370 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 0.0840 -0.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 1.3850 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 2.2640 0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 1.8370 -0.1820 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9700 2.6070 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 2.3470 -1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 1.6070 -2.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 2.4720 -3.6630 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 3.7250 -3.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 3.6600 -1.9670 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 4.8750 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 5.5880 -1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8670 7.0600 -1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3370 7.0280 -2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8980 5.9150 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 0.2480 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3640 -0.9990 2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7630 -0.7540 1.6500 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0090 -0.3530 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1930 0.9030 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 -0.8970 2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9110 -0.0540 2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9380 -0.1840 3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8550 -1.1670 4.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7670 -2.0260 4.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7450 -1.8850 3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8710 -1.2560 5.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 2.4520 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 0.0820 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -1.3760 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 3.2950 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 4.5960 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 5.2160 -2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 5.4460 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 7.5890 -2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 7.5560 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 6.7750 -3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 7.9860 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 6.3170 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8400 5.5190 -1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 0.0350 1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 1.1020 2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2280 -1.2200 3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 -1.8620 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0670 -0.1740 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7010 -1.1750 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5070 1.7650 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 1.1290 -1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9970 0.7480 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7920 0.4860 3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6930 -2.8090 5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9190 -2.5920 3.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6690 -1.9720 5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 0.6700 0.2220 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3690 -0.1070 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 57 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 57 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END