PUBCHEM-ZINC02768136 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 0 0 0 0 0 0999 V2000 0.3370 1.2220 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -0.1850 0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -0.6690 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 0.1300 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -0.4510 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 -1.8400 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -2.6440 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -2.0700 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -2.7850 -0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -4.2030 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0550 -2.4660 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5070 -2.6480 -1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3540 -3.5960 -2.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6380 -4.3800 -2.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8760 -3.7150 -2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0690 -4.4370 -2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0130 -5.8410 -2.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7860 -6.5250 -2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6040 -5.7850 -2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8540 -7.8920 -2.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6330 -8.6190 -2.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1810 -6.5590 -2.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.7120 -6.8870 -3.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3210 -3.8810 -2.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4230 -2.4650 -2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 1.4230 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 1.7370 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 1.6060 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 1.2130 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4150 0.1970 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 -3.7220 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -4.6000 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -4.5800 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -4.5570 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0350 -3.4320 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7720 -1.8420 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6350 -1.6850 -1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8030 -3.2670 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5830 -4.1430 -3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4980 -2.6210 -3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8880 -2.6290 -2.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6400 -6.2850 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0930 -8.4550 -3.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0100 -8.3710 -1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8770 -9.6840 -2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6350 -7.4540 -3.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9610 -5.9850 -4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0200 -7.5160 -4.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4850 -2.2050 -2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9290 -1.9970 -1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0260 -2.0810 -3.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8290 -3.3470 -1.4560 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.7600 -4.2510 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5310 -2.8040 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 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 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END