IBS-ZINC04116424 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 0.8410 0.4210 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -0.7320 -0.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -1.1040 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -2.2400 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 -2.7310 0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4130 -2.0780 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1590 -0.9500 -0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 -0.4630 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7730 -2.6410 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9110 -3.8500 0.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9230 -1.7030 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1720 -2.1920 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3850 -1.4310 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4930 -0.0570 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8260 0.2670 0.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5970 -0.8720 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7140 -1.9590 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2550 -3.2630 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6410 -3.4410 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4940 -2.3460 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9900 -1.0450 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3360 1.6300 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5990 2.0590 1.7270 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.7310 1.8540 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9630 3.5510 1.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7780 4.8290 3.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5340 4.8920 4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6380 5.1260 5.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6770 4.0710 5.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8180 3.9690 4.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7270 1.3660 2.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5110 0.4110 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 0.5840 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 0.2700 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 1.3120 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -2.7500 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 -3.6210 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9540 -0.4440 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 0.4140 -1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7250 -0.6400 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2930 -3.2750 0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7380 0.7160 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6030 -4.1320 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0510 -4.4470 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5690 -2.5040 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6710 -0.1990 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5890 2.2810 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2490 1.6760 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0960 4.2180 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6570 3.8120 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4530 4.5770 2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2580 5.7700 2.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2520 5.7180 4.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0950 3.9690 4.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0430 4.2960 6.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1970 3.1270 5.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2680 4.8990 4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1240 3.1260 4.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7160 3.7540 3.1030 N 0 3 0 0 0 0 0 0 0 0 0 0 -12.1890 2.8280 3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 39 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 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 31 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 59 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END