PUBCHEM-ZINC05456007 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.8600 0.6660 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -0.5360 0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -0.5300 2.2640 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8140 -1.5220 2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 0.3500 2.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 0.0560 2.8420 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6640 -0.7300 3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -0.3620 1.0510 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 1.5140 3.3090 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1170 1.5710 4.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 1.5670 3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 2.3960 3.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 2.4350 2.2840 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 3.5170 2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 3.7960 3.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 4.3430 1.3810 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6000 4.3150 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 3.7260 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6220 3.2460 -0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 2.6540 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9270 2.5360 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9710 3.0080 0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8420 3.6000 1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 6.4660 1.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -0.3220 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -0.3350 3.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -1.8490 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 0.6050 -0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 0.7100 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 1.6180 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 2.2490 1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7160 3.3240 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 2.2860 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8060 2.0770 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8850 2.9160 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9000 3.9600 2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 6.0210 2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 7.5010 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 6.4980 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -1.9930 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -2.7130 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -1.8660 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 5.7540 1.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 5.7500 2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 -0.2500 1.5510 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 25 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 43 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 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 45 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 43 44 1 0 0 0 0 M CHG 1 45 -1 M END