IBS-ZINC02438361 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 0 0 0 0 0 0999 V2000 -0.2290 1.5600 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 0.0470 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -0.5040 0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -1.8640 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -2.7660 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -4.1460 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -4.6420 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 -3.7600 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8360 -2.3770 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 -1.4810 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0220 -0.6590 -1.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0120 -1.6940 0.5360 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2750 -0.9700 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3840 -1.8410 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7610 -1.1850 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8020 -0.0190 0.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 2.0340 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 1.8830 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 1.9160 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -0.2820 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -0.2490 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -2.4290 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -4.8350 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 -5.7140 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 -4.1520 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 -2.3800 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4880 -0.6860 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1610 -0.0520 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1720 -2.0840 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4270 -2.7910 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7080 -1.9110 -0.3950 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 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 22 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 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 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 M CHG 1 31 -1 M END