IBS-ZINC02371070 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 -0.8240 0.3670 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -1.1260 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -1.4660 -1.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -2.7790 -1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -3.8220 -1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -5.1220 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -5.3900 -2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -4.3570 -3.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -3.0520 -2.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -4.6260 -4.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -5.6250 -4.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 -5.4270 -5.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -4.3800 -6.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -3.8730 -5.3480 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1270 -3.8270 -7.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -2.7400 -7.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 -2.1840 -9.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 -2.7060 -9.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 -3.7840 -9.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 -4.3480 -8.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 -6.5670 -3.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 -7.7920 -3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2310 -8.5950 -2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 -8.2060 -1.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 -9.8050 -2.6310 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8890 -10.0500 -3.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5120 -11.3880 -4.7680 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 -8.6750 -4.8770 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 -10.7280 -1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 -11.7110 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -12.6650 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 -13.7120 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -13.7510 -0.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 0.6370 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 0.9290 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 0.6810 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -1.6620 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -1.3640 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -3.6580 -0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -5.9300 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -6.4070 -2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -2.2350 -3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3910 -5.9220 -6.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 -2.3130 -7.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 -1.3440 -9.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 -2.2720 -10.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0710 -4.1890 -10.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7380 -5.1870 -8.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -6.2260 -2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1290 -11.2750 -1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5640 -10.1440 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 -11.1570 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 -12.2800 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5310 -13.2070 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 -12.0870 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0470 -14.4200 1.3530 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 33 2 0 0 0 0 32 56 1 0 0 0 0 M CHG 1 56 -1 M END