PUBCHEM-ZINC05859053 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 61 0 0 1 0 0 0 0 0999 V2000 2.2320 3.5370 6.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 2.1890 7.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 1.3340 6.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 0.0390 7.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -0.8540 6.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.2230 5.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -2.4870 4.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -2.3860 3.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -2.5090 3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 -3.2380 4.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 -3.5810 5.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -3.4940 6.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -4.9660 4.6250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0090 -4.9320 4.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -5.4580 3.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -6.1120 6.2930 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1870 -6.1170 5.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -7.4570 7.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -8.6580 6.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -9.9620 6.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -10.4970 6.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -11.6910 7.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -12.3570 8.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -11.8300 8.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -10.6360 7.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -5.0030 7.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -4.3180 7.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1830 -4.9480 7.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 -3.8690 8.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1600 -3.8480 8.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 3.9750 6.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 4.2280 7.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 3.4290 5.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 1.7560 7.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 2.3090 8.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -0.3990 7.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 0.1510 8.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -1.7400 6.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -0.3220 5.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -1.4330 2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -3.1910 2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 -5.5230 4.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 -6.4490 3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 -4.7740 2.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -7.4740 7.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -7.5490 7.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -8.5970 5.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -8.6540 5.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -9.9810 6.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0960 -12.0970 7.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 -13.2850 8.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -12.3490 8.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -10.2340 7.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -4.0260 9.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 -2.9170 7.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5610 -3.0390 8.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 -3.7130 7.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -4.7990 8.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4150 -1.8800 3.0790 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9110 -5.9270 5.7520 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 -5.5600 6.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 59 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 60 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 16 60 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 60 61 1 0 0 0 0 M CHG 1 59 -1 M END