PUBCHEM-ZINC06131544 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 0 0 0 0 0999 V2000 -0.4020 1.2900 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -0.2100 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -0.8900 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 -2.2840 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -3.0060 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -2.3390 -1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -0.9440 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -4.7760 0.1630 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -5.1600 -1.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -5.1500 1.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 -5.3590 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -5.4380 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 -6.8590 -1.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 -6.9900 -3.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -8.6740 -4.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -8.8140 -4.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6310 -5.2700 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1560 -3.8920 1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 -3.4670 2.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -2.1990 3.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1340 -1.3920 2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0990 -1.8940 0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -3.1240 0.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 1.6860 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 1.6500 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 1.6870 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -0.3360 2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -2.7900 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 -2.8860 -2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -0.4280 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3940 -5.2020 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 -4.7080 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -7.1210 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 -7.5690 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -6.7450 -3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -6.3400 -3.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 -8.0200 -5.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3870 -8.4640 -4.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -9.7270 -5.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 -8.7670 -3.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -8.1320 -4.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -9.8440 -4.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 -5.9200 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -5.7120 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 -4.1020 3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -1.8440 4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5180 -0.3980 2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 -1.3000 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 -8.4180 -3.7930 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8320 -9.0410 -3.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 49 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 49 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END