IBS-ZINC02114423 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 0.1610 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -0.4470 -3.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -1.8180 -3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -2.6120 -2.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -1.9960 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.7500 -0.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -3.1280 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -4.0240 -2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -4.9730 -1.9240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -4.1160 -3.6390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -2.7720 -4.2730 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7760 -2.7310 -5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -2.5480 -4.5220 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4600 -4.3170 -4.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 -5.0290 -4.3730 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5120 -5.8340 -3.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 -5.6230 -5.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -5.3120 -5.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0430 -6.4990 -6.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 -7.0760 -7.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -8.0180 -8.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 -9.3840 -8.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -10.2480 -8.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 -9.7460 -9.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0060 -8.3800 -9.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 -7.5140 -9.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 -6.1790 -9.2080 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 1.2380 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 0.1580 -3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -3.7260 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 -2.2320 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -3.7120 -1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5480 -4.4620 -5.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3540 -4.6740 -4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 -6.7470 -6.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -7.6230 -7.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -6.2780 -8.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 -9.7770 -7.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 -11.3150 -8.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4810 -10.4220 -10.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 -7.9890 -10.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 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 25 44 1 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 30 1 0 0 0 0 M END