PUBCHEM-ZINC05559976 MOE2007 3D CORINA 3.40 0006 02.08.2006 75 76 0 0 1 0 0 0 0 0999 V2000 0.1420 1.4640 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -0.0310 -0.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7050 -0.2540 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -0.8390 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -1.6240 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 -2.3870 -2.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -2.5670 -3.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -2.8550 -2.7360 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -3.5940 -3.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 -3.4650 -4.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5280 -4.2130 -5.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 -5.9000 -5.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0890 -5.0710 -3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -7.4000 -4.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 -5.6320 -6.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1930 -3.5110 -6.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0600 -4.3420 -5.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 -1.7310 0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2290 -1.7960 0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7160 -3.1940 1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -3.5440 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -2.1290 2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -4.6410 1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 -3.7420 3.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6920 -4.2000 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1580 -3.1060 1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 1.7380 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.7570 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 2.0600 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -0.7630 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 -1.7200 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 -2.6840 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 -3.1430 -4.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2680 -2.4030 -4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 -3.8440 -3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -5.4850 -2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -5.1650 -3.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -7.6820 -4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 -8.0190 -5.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 -7.6620 -3.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -4.5710 -6.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 -6.1250 -7.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -6.0200 -6.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 -2.5730 -6.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4590 -4.1320 -7.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 -3.2440 -6.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3630 -4.8680 -4.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4690 -4.8950 -6.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5360 -3.3550 -5.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -2.3600 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -1.0650 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 -1.4870 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -2.0750 1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -1.4010 2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -4.6620 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -5.6330 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -4.4910 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 -3.0020 4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -4.7370 4.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -3.6410 4.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 -4.2210 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 -5.2160 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -3.9420 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8400 -2.7390 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5220 -4.0870 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 -2.4220 2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9830 -5.6260 -5.3210 N 0 3 0 0 0 0 0 0 0 0 0 0 5.5350 -6.1650 -4.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 -6.0660 -6.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -0.3100 0.3720 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5670 0.3220 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -0.0020 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 -3.6990 2.5210 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0930 -4.6950 2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 -3.2440 3.3800 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 4 1 0 0 0 0 2 70 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 11 67 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 67 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 50 1 0 0 0 0 18 70 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 25 1 0 0 0 0 20 26 1 0 0 0 0 20 73 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 21 73 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 67 68 1 0 0 0 0 67 69 1 0 0 0 0 70 71 1 0 0 0 0 70 72 1 0 0 0 0 73 74 1 0 0 0 0 73 75 1 0 0 0 0 M CHG 1 67 1 M CHG 1 70 1 M CHG 1 73 1 M END