IBS-ZINC02066042 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.0450 1.5150 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -0.0150 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -0.5140 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -2.0440 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -2.5220 2.4210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -2.7680 3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -2.6090 3.6420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -3.2200 4.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -3.5520 5.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -4.0890 6.8870 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -4.3470 8.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -4.8940 9.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -5.0900 10.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -4.7540 10.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -4.2140 9.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -4.0140 8.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -3.3540 6.5680 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 -4.3860 6.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -3.2760 3.9590 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 -2.7260 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 -2.4830 1.0530 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 1.9010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 1.8710 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 1.8630 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -0.4010 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -0.3620 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -0.1280 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -0.1670 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -2.4300 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -2.3920 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 -5.1640 9.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 -5.5130 11.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -4.9120 11.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -3.9480 9.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -3.4570 6.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 -4.8870 7.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 -5.0360 5.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 M END