IBS-ZINC04982005 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.6590 1.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.0350 2.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -0.6450 3.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -1.8620 3.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 0.0840 4.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -0.4680 6.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 0.6280 6.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 1.7240 6.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 1.4400 4.9500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 2.0900 4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 0.5600 8.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -0.6710 9.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -0.7330 10.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 0.4270 11.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 1.6600 10.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 1.7270 9.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 2.7970 11.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 4.0260 10.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 0.3620 12.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -0.9350 13.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.7340 -1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.1320 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.8100 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -2.1070 -3.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.7180 -3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.0310 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -2.7800 -4.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -1.9950 -6.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 1.0050 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -1.5170 6.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -1.5760 8.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -1.6880 10.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 2.6830 8.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 4.8520 11.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 4.1710 9.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 3.9920 9.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -1.5640 12.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -1.3850 12.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -0.8450 14.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -2.6790 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -3.8900 -2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.1750 -4.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 1.0490 -2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -1.3780 -6.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -1.3540 -6.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -2.6540 -6.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 M END