PUBCHEM-ZINC05985943 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 1.3840 2.1390 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 1.2860 2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 3.5560 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 3.5620 2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 4.9910 2.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 5.0210 3.7750 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 5.2870 5.2110 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6720 6.2090 5.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 5.5910 5.6520 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0850 5.0950 7.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 5.7860 8.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 5.1170 9.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 5.7460 10.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 6.9740 10.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 7.6010 9.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9760 7.0570 8.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7950 4.1070 7.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 5.0090 4.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 4.8120 4.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 4.7850 3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 4.4730 2.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 4.1590 5.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 2.8340 5.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 1.8140 6.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 2.1010 7.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 3.4080 7.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 4.4350 6.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 3.6460 8.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 1.1010 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 2.6100 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 2.6920 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 1.7690 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 0.3040 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 1.1720 2.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 4.1130 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 3.9880 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 2.9840 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 3.0720 3.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 5.5480 3.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 5.5150 1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 4.1270 9.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1190 5.2640 11.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 8.5920 9.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 7.6450 7.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 6.6680 5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 2.5780 5.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 0.7960 6.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 1.3120 7.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 5.4500 6.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 4.6050 8.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 2.1410 1.0030 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2930 1.6980 0.7950 H 0 0 0 0 0 0 0 0 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 1 51 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 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 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END