IFLAB-ZINC04163104 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -3.8960 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -4.6460 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 -4.1090 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -6.1340 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -6.6710 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0430 -6.9470 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3480 -6.4900 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1920 -7.5380 0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1590 -7.4660 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4940 -8.7290 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 -8.4210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 -9.4400 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5920 -10.7560 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9440 -11.0630 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8920 -10.0620 0.0140 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -2.1110 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -2.1010 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -4.3250 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6440 -5.4520 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 -9.2030 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -11.5500 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2580 -12.0960 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9420 -10.3120 0.0230 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 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 30 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 31 1 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 M END