PUBCHEM-ZINC05840841 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.2660 2.0540 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 0.5320 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 0.0440 2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -0.1040 0.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -0.8960 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -1.4790 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9100 -1.2710 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 -0.4800 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 0.1000 1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2510 -1.9060 0.2010 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3370 -2.1720 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4230 -3.1590 1.0770 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5460 -3.3100 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6390 -2.8460 1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1390 -3.5570 2.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0920 -1.4910 1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0540 -0.9170 2.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3250 -0.9850 0.5760 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.5060 0.2240 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4720 1.0950 0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6410 2.3340 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8450 2.6890 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9190 1.8190 -1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7460 0.6100 -1.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0760 0.0050 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6720 -4.3730 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1540 -4.2460 -0.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -5.7130 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5590 -6.8420 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2360 -8.0940 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6860 -8.2340 1.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4560 -7.1220 2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 -5.8620 1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 2.5140 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 2.4020 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 2.3300 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 0.2560 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 0.3200 3.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -1.0400 2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 0.5040 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -1.0590 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0030 -2.0980 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 -0.3170 2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 0.7150 2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0760 0.8000 1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3800 3.0210 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9680 3.6560 -1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3080 2.1020 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9890 -6.7340 -1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 -8.9660 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 -9.2170 2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 -7.2390 3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -4.9950 2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 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 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 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 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 M CHG 1 18 1 M END