IBS-ZINC02120607 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 -2.5790 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 -2.7140 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8220 -3.1930 -1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4230 -3.5370 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7270 -3.4020 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -2.9280 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -0.6000 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -0.2970 0.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -1.0990 2.3950 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3260 -0.6600 3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 -2.6340 2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3810 -3.2130 2.6090 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0360 -1.5790 3.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9420 -1.4100 4.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1810 -0.6710 2.3200 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 0.2400 1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 1.3110 1.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3960 -0.2570 1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4410 -1.3900 2.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6190 -2.0700 2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7870 -1.6280 2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7730 -0.5020 1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5700 0.1900 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -3.0430 3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -3.1770 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -2.3340 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -2.4890 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 -2.4460 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3660 -3.2970 -2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4360 -3.9100 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 -3.6710 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 -2.8270 2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.7310 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6340 -2.9500 3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7110 -2.1630 2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6880 -0.1590 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5540 1.0700 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -2.5990 3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 -4.1290 3.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 -2.6920 4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 -2.9210 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -4.2610 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -2.7370 1.0730 H 0 0 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 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 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 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END