PUBCHEM-ZINC03735059 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 -0.2300 1.5840 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 0.0840 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -0.5040 -1.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -1.8620 -1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -2.7330 -0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -4.1190 -0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -4.6270 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -3.7720 -2.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -2.3920 -2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -1.5480 -3.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 -1.0710 -3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -0.1520 -4.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -4.1730 -3.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -5.5540 -3.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 -5.7250 -5.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -5.0390 0.6530 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5190 -4.4220 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -5.9730 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -6.6970 2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -7.5250 2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -6.6610 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 -6.1800 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 1.9960 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 1.8150 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 2.0870 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -0.1170 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -0.3030 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -2.3470 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -5.6970 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 -0.5130 -2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -1.9080 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 0.6870 -4.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5510 0.2410 -4.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -0.6870 -5.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 -5.8820 -2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -6.1560 -3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -6.7720 -5.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 -5.3880 -5.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 -5.1170 -5.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -6.7250 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -5.3900 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -7.3650 2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -5.9660 3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -8.2330 1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -8.1280 3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -7.2360 2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -5.7980 3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 -6.9480 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -5.2760 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 -5.8710 0.1030 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6090 -5.3760 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -6.7460 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 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 28 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 50 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 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 21 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 M CHG 1 50 1 M END