PUBCHEM-ZINC02991962 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.3950 -0.0460 -1.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -1.5160 -1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -2.0260 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -3.3730 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -4.2140 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -3.6990 -2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 -2.3500 -2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -1.7890 -3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -5.5790 -0.7580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -5.9880 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -5.1720 1.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -7.4600 0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -7.6420 2.2900 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -7.7450 3.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -7.6940 2.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -7.9250 4.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -8.0580 5.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -8.4060 6.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -8.1190 7.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -8.4480 9.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -9.0650 9.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -9.3530 8.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -9.0330 7.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -10.0100 8.5110 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8040 -10.2630 7.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -10.2970 9.6380 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3770 -7.9290 4.6050 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -7.7120 2.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7280 -7.6390 2.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 0.1280 -2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 0.2770 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 0.5180 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 -1.3720 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 -3.7710 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -4.3500 -2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -1.8340 -4.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 -2.3740 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -0.7520 -3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -6.2300 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -7.9400 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -7.9100 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -7.9070 5.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 -7.6390 7.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -8.2260 10.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -9.2610 6.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -9.3870 10.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -10.2720 10.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END