PUBCHEM-ZINC05850692 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -0.6440 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -0.9290 1.3900 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5780 -0.0610 2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 1.1410 1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 1.8010 2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1790 1.2910 3.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 0.1070 4.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -0.5780 3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -1.7540 3.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -2.3520 4.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -1.9210 2.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -3.0840 1.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -4.2480 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -5.4280 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -6.5430 0.4760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -7.6970 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -7.8130 0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -8.8120 -0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -10.0260 -0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 -10.8890 -1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4130 -10.4000 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -8.8030 -0.4750 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -1.7230 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -0.0910 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 -0.2350 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -1.7590 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 1.5470 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4520 2.7300 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8060 1.8250 4.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 -0.2860 5.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -2.7820 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -3.3980 2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 -4.5490 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 -3.9340 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -5.1270 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -5.7420 1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 -6.4500 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -10.2820 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -11.8880 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 -10.9460 -1.3320 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 2 0 0 0 0 2 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 M CHG 1 5 1 M END