PUBCHEM-ZINC05413439 MOE2007 3D CORINA 3.40 0006 02.08.2006 74 75 0 0 1 0 0 0 0 0999 V2000 0.4340 0.9160 -0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -0.3870 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 -0.2660 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -1.4640 2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -1.3970 3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -2.5010 4.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -2.2180 5.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -1.0930 5.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -3.3570 5.9070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 -3.4090 6.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -2.5230 6.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -1.2160 7.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 -0.1190 6.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 2.3250 7.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 3.0450 6.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 4.3290 5.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2380 4.7920 4.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 6.0740 3.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 6.6530 3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1550 5.6520 2.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4890 4.1850 2.9670 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3670 3.8810 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3460 3.2110 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 3.0750 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 2.1370 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 1.7670 -0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 0.6600 -1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 1.5190 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -1.1750 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -0.7170 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 0.6500 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 -0.1870 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -2.3960 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -1.4810 2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -0.4120 3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -1.5090 2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -2.5880 4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -3.4660 3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -4.2370 5.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -3.1840 7.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -4.4560 6.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 -3.0630 6.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 -2.3300 5.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -0.8710 7.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 -1.4080 8.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5230 -0.3960 6.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 0.1350 5.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0710 1.9960 6.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 2.9710 7.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 2.3670 5.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 3.3260 6.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 4.9450 5.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 4.9190 6.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0460 4.1050 4.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3270 4.9850 5.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9210 6.8170 4.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9100 5.8690 2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 6.9420 4.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 7.5720 2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 5.8620 2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 5.8270 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6060 2.2160 3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 3.5260 3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 4.0530 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 2.6810 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 1.2250 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 2.6200 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 1.2230 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 2.6810 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 1.1170 7.5910 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4320 1.3400 7.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 0.8830 8.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 4.0380 4.4310 N 0 3 0 0 0 0 0 0 0 0 0 0 5.1990 3.0510 4.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 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 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 13 70 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 14 70 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 16 73 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 17 73 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 20 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 21 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 73 1 0 0 0 0 23 24 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 24 25 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 25 26 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 26 68 1 0 0 0 0 26 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 M CHG 1 70 1 M CHG 1 73 1 M END