IBS-ZINC05304721 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6990 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0780 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7740 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0650 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2450 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -4.8570 1.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.9920 -1.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7730 -4.5540 -2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -5.0170 -1.9310 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0590 -5.3220 -1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -6.1800 -2.9760 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3050 -5.8200 -3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -7.2290 -2.1000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2690 -7.8200 -1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -6.7240 -1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -8.1830 -2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -8.1260 -2.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -6.1060 -3.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -7.0250 -4.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6610 -4.7680 -3.7440 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -4.0220 -2.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -2.8180 -2.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -4.2160 -4.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9470 -4.1050 -4.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8990 -3.5610 -5.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5430 -3.1280 -6.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2330 -3.2370 -6.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -3.7750 -5.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 -3.8880 -6.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5850 -2.5350 -7.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1600 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6180 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5950 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1370 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 -6.7090 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -6.0160 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -8.3700 -2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 -8.9340 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -9.1220 -3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -7.6750 -3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2260 -4.4440 -3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9240 -3.4740 -4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 -2.8980 -7.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -4.8490 -6.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -3.0830 -7.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -3.8140 -5.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6350 -1.4570 -7.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3180 -2.7390 -8.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5560 -2.9800 -6.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -6.4480 -1.1150 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 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 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 56 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 56 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 2 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 31 32 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 M END