IBS-ZINC04295416 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 0.4930 1.0840 0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -0.1620 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -0.5250 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -0.9910 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -2.1110 -0.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -2.9650 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0690 -2.7260 0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1330 -3.5880 0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2490 -4.7040 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 -4.9440 -0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -4.0690 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -6.0290 -1.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3910 -5.6320 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7000 -5.1400 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7360 -6.0500 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4590 -7.3450 0.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2120 -7.7800 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1930 -6.9480 0.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9680 -9.1440 0.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9480 -3.8030 0.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2220 -3.3830 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0530 -3.0970 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3480 -2.6710 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8190 -2.5280 0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9960 -2.8110 1.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6980 -3.2440 1.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8890 -3.5290 2.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4440 -3.3640 4.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 1.5460 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 1.7840 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 0.8220 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -1.4180 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 0.0690 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -1.3440 1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -0.3820 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9800 -1.8620 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 -3.3990 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -4.2480 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8850 -5.8660 -2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7570 -5.7080 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7060 -9.7650 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -9.4770 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6880 -3.2080 -1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9940 -2.4480 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8320 -2.1940 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3660 -2.6990 3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6960 -3.6240 4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7500 -2.3260 4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3110 -4.0150 4.2510 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 2 0 0 0 0 2 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END