IBS-ZINC06645553 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -0.3920 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -1.9100 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -2.2370 -2.9980 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6850 -1.7310 -3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -3.7260 -3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -4.3440 -4.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -1.7830 -4.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 -1.4910 -5.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -1.6040 -5.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -1.0230 -6.4830 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0240 -1.7900 -6.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 0.2690 -6.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 0.7270 -7.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 1.0100 -8.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -0.1830 -8.7710 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -0.7610 -7.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -0.8640 -10.2800 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -2.2220 -10.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -0.4720 -10.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 -0.0970 -11.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -0.6340 -11.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 -0.0320 -11.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2020 1.1070 -12.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 1.6440 -12.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 1.0390 -11.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 0.0240 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 0.0400 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -2.3260 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.3420 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -1.6920 -4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 0.0910 -5.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 1.0430 -5.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 -0.0560 -7.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 1.6350 -7.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 1.2410 -9.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 1.8540 -8.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -0.0620 -7.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -1.6990 -8.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 -1.5240 -10.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4460 -0.4510 -11.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 1.5780 -13.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 2.5340 -13.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 1.4560 -11.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 -4.3650 -2.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 -5.3200 -2.2540 H 0 0 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 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 49 1 0 0 0 0 9 10 1 0 0 0 0 9 35 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 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 49 50 1 0 0 0 0 M END