PUBCHEM-ZINC03825455 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 0.9240 1.0490 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -0.4470 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -0.8290 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -2.2450 0.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 -2.6870 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -4.2050 1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -4.7700 2.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -6.2950 2.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -6.8610 4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 -8.3880 4.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 -8.7910 5.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 -9.4140 6.8380 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2340 -8.8710 7.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -10.8820 6.9200 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5390 -11.4510 6.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 -11.0090 7.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3210 -10.5720 7.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -10.3700 5.8520 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0190 -10.9750 4.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -10.2430 6.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -9.0700 7.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -9.0790 7.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 -12.4040 7.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -12.7780 7.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 -11.4810 8.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6860 -11.6270 7.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9690 -9.3020 6.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3280 -9.3820 7.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 1.4010 -1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 1.2940 -2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 1.5990 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -0.7850 -1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -0.9810 -2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 -0.5320 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -0.3340 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 -2.4100 1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -2.2100 2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -4.4680 1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -4.6630 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 -4.4960 2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 -4.3190 3.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -6.5700 2.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -6.7440 2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 -6.5430 4.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 -6.4350 5.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -8.6830 4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4050 -8.8600 3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1590 -7.7230 5.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3300 -9.2470 4.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -10.1210 5.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -11.1130 6.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 -8.9440 5.5540 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9720 -8.3880 6.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 10 52 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 11 52 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 52 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END