PUBCHEM-ZINC03589877 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 69 0 0 0 0 0 0 0 0999 V2000 0.4520 1.2740 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -0.1260 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -0.7270 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 0.0100 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 -0.9200 1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -2.1850 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 -2.0580 0.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -2.8280 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 1.4180 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 2.0620 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 3.5310 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 4.2630 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 5.6590 -0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 6.3590 -0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 5.6470 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 4.2420 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 6.3620 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 7.5430 -1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 7.9410 -2.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0440 9.3520 -4.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2670 10.2800 -4.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3000 9.0020 -2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 8.1050 -2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 7.7280 -0.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 8.4620 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 9.9310 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 10.7470 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 1.7500 -1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -0.7170 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -0.6900 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 -3.1610 1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 1.9960 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 3.7430 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 6.1650 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 3.6830 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 5.7010 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 7.2350 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0250 8.4240 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 6.8510 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 8.4860 -3.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 7.0390 -3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1630 8.5320 -4.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 9.9300 -4.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1470 11.1700 -3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4670 10.5860 -5.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2050 8.4350 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2140 9.8540 -1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9210 7.7760 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2250 7.2090 -2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 8.0780 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 8.3800 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 10.3250 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 10.0060 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 10.4000 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 10.7360 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 6.8370 -1.4240 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1290 7.4580 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 6.0260 -2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8310 8.8070 -2.7810 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4880 9.5580 -3.7430 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.2950 10.1980 -3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7210 8.7970 -4.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 12.1650 0.3720 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6540 12.7270 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 12.2680 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 12.5960 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 56 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 56 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 59 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 59 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 60 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 60 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 63 1 0 0 0 0 56 57 1 0 0 0 0 56 58 1 0 0 0 0 60 61 1 0 0 0 0 60 62 1 0 0 0 0 63 64 1 0 0 0 0 63 65 1 0 0 0 0 63 66 1 0 0 0 0 M CHG 1 56 1 M CHG 1 60 1 M CHG 1 63 1 M END