IBS-ZINC05177385 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 37 0 0 0 0 0 0 0 0999 V2000 0.3120 1.4290 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -0.0340 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -0.6850 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -0.0740 2.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -2.1570 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.8920 2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -4.2350 2.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -5.0220 3.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -6.5090 3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -7.2980 4.3590 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4840 -6.9020 5.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -8.7260 4.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -7.0560 5.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -2.8110 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -4.0220 -0.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -2.0300 -1.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -0.6950 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -0.0490 -2.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 1.8460 0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 1.7600 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 1.7700 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -2.3890 3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -4.6820 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -4.8420 4.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -4.7280 4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -6.6890 2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -6.8040 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -7.0820 4.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -7.4870 6.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -5.8420 5.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -9.0200 3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 -9.3120 4.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -8.9060 3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -5.9960 5.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -7.6410 6.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 -7.3500 4.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -2.4450 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 M CHG 1 10 1 M END