IBS-ZINC05387946 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4050 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 1.3100 -0.3780 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 0.7380 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -1.7660 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -2.0100 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -3.3040 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -4.3250 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 -5.4980 -0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -3.9950 -0.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -2.7710 -0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -5.0610 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -5.4340 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -4.7840 2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -5.1260 3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -6.1180 4.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -6.7690 3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -6.4300 2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -6.4840 5.4020 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8120 -5.9100 5.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -7.3580 5.9650 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8940 2.0350 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -0.6600 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 2.8450 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 -1.1930 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 -3.5420 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -4.7130 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -5.9340 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 -4.0090 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -4.6180 3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -7.5440 3.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -6.9410 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 12 2 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END