PUBCHEM-ZINC06201118 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 49 0 0 1 0 0 0 0 0999 V2000 -0.3740 1.2380 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -0.2260 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -1.1310 1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -0.5080 -0.2370 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5140 -0.3430 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -1.9410 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -2.3090 -1.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 -2.7410 -0.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 -4.1130 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 0.3390 -1.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 1.4310 -1.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 1.8130 -0.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 2.0560 -2.8270 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6840 3.2730 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 3.0000 -3.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7870 4.3080 -4.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6600 5.2830 -5.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0170 4.9730 -6.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9590 4.5620 -5.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5300 3.3670 -4.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1930 3.5770 -3.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 1.4090 1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 1.9170 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 1.5160 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -0.4260 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -1.0170 2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.1850 1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 -0.8870 2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 -4.2080 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 -4.5460 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -4.6560 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 0.0810 -2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 1.6580 -3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 3.9360 -2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 3.7600 -3.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 2.3610 -4.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 2.4390 -3.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9410 4.9430 -3.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1970 4.8610 -4.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9220 5.5430 -6.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7370 6.0830 -4.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4140 5.8720 -6.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9340 4.1940 -6.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2990 3.0960 -3.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4650 2.5520 -5.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2710 4.3580 -2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8430 2.6420 -3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1440 4.0480 -4.7340 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.0220 3.3010 -5.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END