PUBCHEM-ZINC06468454 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 67 0 0 1 0 0 0 0 0999 V2000 0.0680 2.2110 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 0.6720 0.1270 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9490 0.3220 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 0.0900 1.3430 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7670 -1.0060 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 0.4410 1.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 -0.0250 0.0430 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7960 -1.1230 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 0.4930 -1.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 0.1240 -1.1380 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7490 -0.9750 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 0.5690 -2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 0.0470 -2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 0.4580 -3.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 1.4030 -4.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 1.9110 -4.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 1.5010 -3.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 1.8300 -6.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 2.0830 -5.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2580 0.4500 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 -0.4400 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 0.0030 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9370 1.3490 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 2.2420 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 1.7970 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3600 1.8190 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 0.5870 2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -0.0240 4.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -0.1060 5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -0.6250 6.1400 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8670 -0.3730 7.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 0.0080 5.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -2.0430 5.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -2.4360 6.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 2.6370 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 2.6140 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 2.5840 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -0.6830 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 0.0440 -4.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 2.6370 -5.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 1.9240 -3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 2.7480 -6.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 1.0380 -6.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 2.3680 -6.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -1.4890 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4270 -0.7170 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0830 3.2930 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 2.5040 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4440 2.8620 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9970 1.2120 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 1.6330 2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 0.4530 2.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 0.9560 3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -0.8270 3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 -0.7500 5.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 0.8970 6.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -0.5010 5.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 1.0870 5.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9370 1.7390 -1.3670 N 0 3 0 0 0 0 0 0 0 0 0 0 9.9150 2.0540 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4150 2.3250 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9150 0.7770 -1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -0.2110 3.8410 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7070 -1.2190 3.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 59 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 63 1 0 0 0 0 33 34 1 0 0 0 0 59 60 1 0 0 0 0 59 61 1 0 0 0 0 59 62 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 59 1 M CHG 1 63 1 M END