IFLAB-ZINC04339604 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.7600 0.9170 -1.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -0.4510 -1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -1.0400 -0.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -2.2430 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -3.0160 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -4.2280 0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -4.6740 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7970 -3.9140 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -2.7040 0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0250 -1.8820 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 -2.3310 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4410 -1.4360 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4860 -0.2220 0.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5490 -2.3420 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8940 -2.0860 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7360 -3.1840 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2070 -4.4900 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8340 -4.7440 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0240 -3.6350 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6530 -3.6570 0.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2630 -6.1290 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6090 -7.6630 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7120 -7.8440 -2.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5170 -7.8830 -3.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4110 -6.6550 -3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3020 -6.4740 -2.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0410 -5.5550 -0.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 1.4140 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 0.8300 -2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 1.5500 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -1.0680 -1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -0.3320 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -2.7040 -0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -4.8160 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -5.6080 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6920 -4.2690 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8620 -0.8100 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2840 -1.0740 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8040 -3.0100 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5930 -6.2600 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0270 -6.9120 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2950 -8.5070 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 -7.5370 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -7.0230 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1370 -8.7710 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8390 -7.9390 -4.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1350 -8.7890 -3.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 -5.7620 -4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0340 -6.7450 -4.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8540 -5.5320 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0060 -7.3050 -2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9630 -5.2420 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4440 -6.4140 -1.4960 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.7920 -5.6240 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 2 0 0 0 0 12 14 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 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 53 1 0 0 0 0 27 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END