PUBCHEM-ZINC00468408 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 2.6780 0.8280 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -0.5140 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -0.9310 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -0.0290 -0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 1.3080 -0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.7510 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 3.1330 -0.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 3.8790 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 3.3010 0.2670 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 5.2360 0.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 6.3820 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 7.5070 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1290 8.7450 1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5970 9.2310 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2870 8.1190 -0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4040 6.8780 -1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -2.6670 0.2170 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -2.8650 -1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -3.3680 0.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -2.7810 1.5110 N 0 5 0 0 0 0 0 0 0 0 0 0 -1.1170 -2.2170 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 1.1160 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 -1.2210 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -0.3560 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 1.9950 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 3.6730 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 5.4610 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 6.0680 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 7.7780 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 7.1550 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 9.5460 1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 8.5140 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 9.5990 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 10.0760 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5450 8.4810 -1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2280 7.8520 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 6.0890 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 7.1100 -1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 1 20 -1 M END