PUBCHEM-ZINC05140555 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 0 0 0 0 0 0999 V2000 -0.4440 1.1820 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 1.4740 -1.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 2.7520 -1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 0.5610 -2.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -0.7000 -1.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -1.6250 -2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -1.3230 -4.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 -0.0770 -4.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 0.8390 -3.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -2.2900 -5.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -3.1910 -5.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -3.9930 -6.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -5.3080 -6.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -6.1170 -7.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -5.6330 -8.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -4.3410 -8.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -3.5220 -7.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -1.8550 -7.7530 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -1.0030 -7.7530 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 -1.8230 -6.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 -3.0870 -5.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -2.9620 -6.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 -3.7030 -7.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9410 -4.6040 -6.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 -4.7100 -5.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -3.9680 -4.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0860 -5.3480 -6.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8820 -5.1090 -7.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5320 -6.3920 -5.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 0.3120 0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 0.9980 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 2.0170 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 3.3660 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 2.6040 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 3.3340 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -1.0040 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -2.5780 -2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 0.2000 -5.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 1.7890 -3.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -1.6510 -6.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -2.5880 -5.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -3.9010 -4.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -5.7120 -5.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -7.1230 -7.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -6.2580 -9.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 -3.9750 -9.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -2.2950 -7.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 -3.5620 -8.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -5.3790 -4.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 -4.0970 -3.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3220 -5.3860 -8.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8060 -5.6990 -7.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1830 -4.0570 -7.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8620 -5.9610 -4.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3790 -6.9560 -6.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7340 -7.1190 -5.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -1.8360 -8.9980 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 33 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 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 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 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 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 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 57 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 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 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 M CHG 1 57 -1 M END