IBS-ZINC02153271 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 56 0 0 1 0 0 0 0 0999 V2000 0.3520 0.6940 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -0.8140 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -1.1240 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 -2.6320 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 -2.9410 0.2210 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5440 -2.3590 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2690 -4.4100 0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8450 -5.0950 -0.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -2.5910 -1.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 -2.2900 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6520 -2.3090 -0.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5570 -1.9300 -2.5000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3530 -2.7260 -3.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 -0.6220 -3.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9700 -1.7690 -2.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7270 -1.9620 -3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1170 -1.9310 -3.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8920 -2.1230 -4.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2860 -2.3520 -5.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0920 -2.5610 -6.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4460 -2.7780 -8.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0360 -2.7970 -8.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4700 -2.9920 -9.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3040 -2.6040 -7.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8830 -2.3840 -5.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1110 -2.1810 -4.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5980 -2.5370 -6.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1140 -3.9210 -6.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6430 -3.8960 -6.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 0.9140 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 1.0360 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 1.2080 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -1.3280 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -1.1560 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -0.6100 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -0.7820 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -3.1460 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -2.9740 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 -2.5760 -1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3770 -0.3620 -3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1470 0.1730 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8640 -0.7450 -3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5840 -1.7540 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9680 -2.0990 -4.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0100 -2.9360 -9.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 -2.1990 -4.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9190 -1.8020 -6.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9980 -2.2670 -7.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7930 -4.6550 -7.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7150 -4.1900 -5.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0430 -3.6260 -7.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0110 -4.8820 -6.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9640 -3.1620 -5.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 -4.9580 1.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 -5.9040 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 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 54 1 0 0 0 0 9 10 1 0 0 0 0 9 39 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 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 26 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 25 2 0 0 0 0 20 21 2 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 54 55 1 0 0 0 0 M END