IBS-ZINC02292414 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 2.5320 -0.0020 0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -0.3380 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -0.5440 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -0.8430 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -1.1350 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 -1.3740 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 -1.3220 -2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -1.0340 -2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 -0.7910 -1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -0.4790 -1.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -0.3260 -2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -1.6600 -0.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3940 -1.8960 -1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.4810 2.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -1.4960 2.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 0.8450 2.9800 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3970 1.6200 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 1.1880 3.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 2.0420 5.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 1.8800 6.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 1.4330 6.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 0.1260 5.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 0.3390 4.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 1.2140 7.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 1.3960 8.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 0.8150 8.1950 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 -0.9220 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 0.5480 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 0.6110 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -1.1760 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 -1.5090 -2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -0.9970 -3.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -1.2890 -2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 0.0360 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 0.3900 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9960 -2.7450 -2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4160 -2.1120 -1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3880 -1.0100 -2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 2.1920 3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 1.1470 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 0.4700 3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 2.3460 5.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 2.8030 4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 2.8320 7.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 1.1290 6.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 2.2020 6.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 -0.1740 5.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -0.6520 6.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 1.1080 3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -0.5930 3.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5410 0.6690 7.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2030 0.6740 9.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 0.7650 4.3350 N 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 14 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 12 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 53 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 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 22 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 M END