PUBCHEM-ZINC06535583 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.0510 1.3870 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 0.4610 -0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -0.2380 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -0.0220 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 0.9170 1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 1.6150 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -0.7510 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 -0.0610 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2000 -0.7470 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2030 -2.1420 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 -2.8520 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7970 -2.1570 0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7270 -3.0140 -0.1490 S 0 0 0 0 0 0 0 0 0 0 0 0 7.3850 -4.2950 -0.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6150 -2.1080 -0.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3270 -3.2720 1.4120 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 -4.3470 2.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9270 -3.7940 3.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6830 -2.7390 4.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1740 -1.6320 3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0210 -2.1880 2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8470 -2.1690 5.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 -2.9130 5.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 1.9300 0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 0.2820 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -0.9510 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 1.1050 2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 2.3340 2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 1.0280 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1250 -0.1840 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9940 -3.9390 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 -2.7260 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1810 -5.0520 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6170 -4.9220 2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0040 -3.3580 3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 -4.6270 4.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5560 -3.2170 4.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3130 -1.0880 2.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7730 -0.8970 3.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9590 -2.5960 2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3050 -1.3760 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2120 -1.0370 5.8040 O 0 5 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 M CHG 1 42 -1 M END