PUBCHEM-ZINC06626451 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 0.1490 1.3330 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -0.0850 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -0.5780 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 0.0870 2.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -2.0950 1.1360 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1270 -2.3710 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -2.7260 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -4.2200 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -4.9600 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -6.2870 0.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -7.0520 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -6.4360 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -5.1560 2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -5.0340 3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -6.1880 4.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -7.4510 3.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -7.5990 2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -2.4930 2.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8810 -2.5380 2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 -2.2540 1.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -2.9540 3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8670 -3.1050 3.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0400 -3.5060 4.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 -3.5760 5.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -3.2590 4.5180 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 -3.9950 6.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3440 -3.0220 7.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 -3.4720 9.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 -5.8540 8.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -5.4340 7.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 1.8390 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 1.6180 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 1.6340 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 -2.4270 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -2.3360 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -4.6540 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -4.0560 4.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -6.0950 5.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -8.3370 4.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -8.5840 2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -2.7330 3.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7600 -2.9790 2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 -3.9680 7.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 -2.9380 7.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 -2.0150 7.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 -2.8510 9.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -3.4700 9.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -5.8790 8.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 -6.8310 8.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 -6.1260 6.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1580 -5.5310 6.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 -4.8700 9.3120 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7540 -4.8890 9.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7070 -5.1680 10.2970 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 36 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 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 52 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END