IFLAB-ZINC04583346 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -3.9110 1.5710 1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 0.1470 1.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -0.5610 0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 0.1020 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -0.6140 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -1.9920 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -2.6680 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3030 -1.9440 0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 -4.1440 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -4.7970 -0.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 -4.7670 0.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 -6.2320 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 -6.7410 -0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1010 -6.0370 -0.6630 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 -4.5970 -0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0000 -3.9990 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0830 -6.5860 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3750 -6.0580 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3150 -6.6360 -2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9120 -7.7110 -3.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6640 -8.1440 -3.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7910 -7.6040 -2.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8240 -8.3270 -3.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1900 -9.4290 -4.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2380 -10.1140 -5.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8260 -9.1450 -6.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4520 -8.0570 -5.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4170 -7.3520 -4.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5990 2.0120 2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 1.8530 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 1.9320 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 1.1810 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 -0.0920 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -2.5480 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 -2.4610 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 -6.6660 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 -6.5100 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4300 -6.5540 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9770 -7.8120 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5430 -4.4390 -1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9250 -4.1120 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4520 -4.0660 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7950 -2.9560 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6340 -5.2240 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3300 -6.2680 -2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3900 -9.0360 -5.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7800 -10.1520 -3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7620 -10.8950 -6.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0120 -10.5540 -4.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8540 -7.3520 -6.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2610 -8.4380 -5.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9020 -6.5580 -4.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6350 -6.9250 -5.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 35 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 16 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 28 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 27 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 M END