IBS-ZINC05164883 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 0.1590 -3.5260 0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.1760 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -0.9220 0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 0.0290 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 1.4340 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 2.0730 -1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 1.3350 -2.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -0.0570 -2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.6790 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -2.0090 -1.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -2.7550 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -0.6200 2.3750 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3900 -1.5330 2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -0.0720 2.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 1.3290 4.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 1.9220 5.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -0.0900 6.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -0.6220 5.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 1.3480 8.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 0.2900 9.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 -0.2920 9.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8110 -1.2960 10.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7530 -1.7280 11.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -1.1530 11.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -0.1480 10.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 0.3380 2.6900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -3.8110 1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -4.2870 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -3.5340 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 2.0180 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 3.1540 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 1.8480 -3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.6290 -3.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -0.8330 2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 0.7570 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 2.1650 3.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2060 0.7670 4.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 2.4890 6.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 2.5670 6.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 0.5010 6.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -0.9250 7.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -1.2920 5.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -1.2250 5.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 1.8720 8.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 2.0920 8.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 0.0340 9.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 -1.7410 10.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 -2.5100 12.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -1.4870 11.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 0.2840 10.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 0.7720 3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 0.4650 4.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 0.8080 7.0110 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9630 0.2330 6.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 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 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 52 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 53 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END