IBS-ZINC04860311 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -0.5120 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -0.0630 2.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0300 1.0260 2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -0.5920 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5350 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -0.4510 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2350 0.2910 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 1.0570 -0.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6210 0.0950 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4620 -0.7340 0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7090 -0.6530 0.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4730 -1.1460 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7510 0.2290 -0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4570 0.7420 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2040 1.6690 -2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2320 2.0840 -2.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5130 1.5810 -2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7740 0.6560 -1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -0.6160 3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -1.6010 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -0.1020 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -1.6810 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 -0.2620 3.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -0.1630 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 -0.1920 2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 -1.5240 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1670 -1.3540 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2080 2.0620 -2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0400 2.8030 -3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3110 1.9130 -3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7760 0.2730 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 -0.2420 3.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -0.2960 4.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -1.7050 3.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -0.0770 1.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 7 42 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 34 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 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 M END