IBS-ZINC05111430 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -0.0440 1.5320 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 0.0260 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -0.6830 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -2.0640 0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -2.7400 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -2.0260 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -0.6450 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -4.1410 -0.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -4.8110 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -4.2150 -2.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -6.2840 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -7.0370 -2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -6.3580 -3.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -8.3790 -2.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -9.1680 -3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -10.6520 -3.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -11.4760 -4.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -13.7410 -5.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -15.2160 -4.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -15.4660 -3.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -14.6660 -2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -13.1850 -3.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -6.9190 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -8.1300 0.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -6.1210 1.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -4.7850 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -4.1230 2.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 1.9120 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 1.9010 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 1.8730 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -0.1560 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -2.6170 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -2.5490 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -0.0890 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -5.8620 -3.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -7.1000 -4.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -5.6190 -3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -8.8220 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -8.8600 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -9.0050 -4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -10.9600 -2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -10.8160 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -11.1690 -4.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -11.3130 -5.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -13.5320 -5.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -13.5220 -5.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -15.8410 -5.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -15.4470 -4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -14.8940 -2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -14.8820 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 -12.9580 -3.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 -12.5720 -2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -6.5230 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -12.9020 -4.0240 N 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 54 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 M END