PUBCHEM-ZINC00585999 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 1.2530 0.8410 -2.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -0.5940 -3.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -1.3490 -3.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -2.7060 -4.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -3.3280 -3.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -2.6000 -3.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -1.2350 -2.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -3.1210 -2.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -4.3940 -2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 -5.0760 -2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9580 -6.3380 -1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -6.8660 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -6.1120 -0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -4.8810 -1.4810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -6.7160 -0.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -5.9180 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -4.7760 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 -4.0590 1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 -4.4960 1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -5.6610 0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 -6.3680 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0860 -6.1300 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0190 -5.2880 0.3320 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7740 -4.3390 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9900 -5.5630 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 -8.0900 -0.5030 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.2200 -7.1240 -1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8310 -4.5260 -2.9770 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 1.2320 -2.3270 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0350 0.5490 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 2.2080 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -0.8820 -4.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -3.2750 -4.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -4.3770 -3.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.6800 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -4.4370 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -3.1680 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 -3.9310 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 -7.2720 -0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 -7.7290 -2.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3840 -7.7870 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 -6.4610 -1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 1.7050 -3.3310 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 1.3890 -3.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 2.7010 -3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3740 -7.3780 1.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 -8.0030 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3170 -7.7430 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 2 0 0 0 0 1 43 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 M CHG 1 23 1 M CHG 1 29 1 M END