IBS-ZINC02292959 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 35 0 0 1 0 0 0 0 0999 V2000 -0.8550 1.2380 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -0.1250 0.1710 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9260 -0.9220 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -0.1970 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -0.3510 -0.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -0.3360 1.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -0.5310 2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -0.5760 2.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -0.6720 3.5670 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -0.8610 4.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -2.3010 5.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -2.4560 6.7030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -2.5660 7.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -2.5420 7.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -2.6960 8.9330 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -2.8430 10.2340 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8120 -3.6460 10.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -1.5480 10.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -3.2170 11.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -3.1780 10.8990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 2.0470 0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 1.3880 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 1.3470 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -0.3490 1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 -0.6410 3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -0.5730 5.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -0.1710 5.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -2.6210 4.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -2.9810 5.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -2.4840 6.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 -2.7260 9.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -1.2320 9.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -0.7340 10.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -1.6630 11.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -0.1050 -2.2110 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4740 -3.5160 12.4640 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 M CHG 1 35 -1 M CHG 1 36 -1 M END