PUBCHEM-ZINC05113072 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 55 0 0 0 0 0 0 0 0999 V2000 0.0320 1.5360 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 0.0070 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -0.5540 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -2.0830 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 -2.6440 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -4.1740 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 -4.7340 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 -6.2640 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6440 -6.8250 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7430 -8.3530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 -8.9910 -0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 2.0960 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 3.6260 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 4.1860 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 5.7150 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 6.2760 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 7.8060 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7170 8.3650 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7130 9.8670 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2560 10.6030 0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2420 12.6470 0.9570 I 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 1.9170 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.8880 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -0.3450 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -0.3740 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 -0.2020 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -0.1730 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -2.4350 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -2.4640 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -2.2930 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3700 -2.2630 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -4.5250 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -4.5540 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7450 -4.3830 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7880 -4.3530 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7050 -6.6140 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 -6.6440 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1600 -6.4730 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2020 -6.4440 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 1.7150 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 1.7460 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 4.0070 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 3.9770 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 3.8040 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 3.8360 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 6.0970 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 6.0660 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8590 5.8940 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8090 5.9250 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 8.1850 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 8.1550 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 7.9710 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2280 8.0270 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 10.3540 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7310 10.1290 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9300 -8.7930 0.0210 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 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 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 56 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 2 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 55 1 0 0 0 0 M CHG 1 56 -1 M END