PUBCHEM-ZINC06603780 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0110 1.5310 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 0.0410 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.4240 -1.2490 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6100 0.0150 -1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 0.1740 -2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -1.9730 -1.2750 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4040 -2.6600 -2.4560 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2430 -3.7490 -2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 -2.3290 -2.2450 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0380 -1.2480 -2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 -2.6810 -0.7970 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8090 -1.9850 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 -4.0750 -0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 -4.4590 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0880 -5.8500 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 -6.4920 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -5.4220 -0.2650 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 -2.9550 -3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 -3.3400 -3.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -2.8570 -4.4370 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -2.4680 -3.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -2.1600 -4.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 -3.1440 -5.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 -4.5800 -6.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -4.9200 -6.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -6.2540 -6.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -7.2590 -6.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -6.9320 -6.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -5.6000 -5.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -2.7980 -0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 -2.4820 -1.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 1.8240 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 2.1440 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 1.7670 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -0.4970 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -0.2000 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 1.2560 -2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 0.0350 -3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -0.2580 -2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7420 -3.7690 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 -6.3510 -0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 -7.5400 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 -2.4690 -6.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 -2.9550 -6.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -4.1490 -6.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -6.5080 -7.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -8.2970 -6.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 -7.7160 -6.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 -5.3620 -5.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -2.3550 -0.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -3.2150 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -3.7130 -0.1290 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 50 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 52 -1 M END