IBS-ZINC03021051 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 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 0 0 0 0 0 0 0 0 0 0 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8150 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -2.5530 0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -2.3880 2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -3.8510 2.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -4.5830 3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 -4.0300 4.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -6.0880 3.3380 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5730 -6.4120 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -6.5790 3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -6.0570 4.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 -6.6450 4.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -7.8720 4.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 -8.5170 3.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -8.4340 5.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 -9.7050 5.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -10.2230 6.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3380 -9.4870 7.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 -8.2260 7.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -7.6940 6.7840 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 -1.0200 -0.3810 0.0100 H 0 0 0 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 2.5600 -2.0380 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -2.0640 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.2930 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -6.2380 2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -7.6680 3.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -6.3280 4.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -6.1300 5.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 -10.2810 4.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 -11.2060 6.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8510 -9.8970 8.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 -7.6570 8.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 -6.7080 6.8420 H 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 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 M END