IBS-ZINC05151512 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 72 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1620 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4510 -3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -1.8300 -3.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -2.6030 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -1.9900 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -3.9580 -2.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -4.6910 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -2.4950 -4.3890 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9290 -3.3680 -4.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 -2.9300 -3.9920 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4950 -2.0580 -3.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 -3.9300 -2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2730 -4.3480 -2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 -4.9940 -3.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0220 -3.9970 -4.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 -3.5920 -5.1950 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6340 -2.5990 -6.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 -2.1640 -6.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -1.0000 -5.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 0.1380 -6.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 0.4620 -7.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 0.7960 -7.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 1.9030 -8.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 2.8470 -8.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 4.0030 -9.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 3.4490 -10.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 2.5050 -10.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 1.3490 -9.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8590 -4.7530 -5.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 1.2390 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 0.1490 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -2.5900 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -4.4430 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -5.7590 -1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -4.4280 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -3.4660 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 -4.8090 -3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8370 -3.4700 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2300 -5.0630 -1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9790 -5.2840 -3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4080 -5.8790 -3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5820 -3.1140 -4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5110 -4.4620 -5.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2230 -1.7270 -6.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0820 -3.0750 -7.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -1.4430 -7.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -3.0350 -6.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -0.6380 -4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -1.7810 -6.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 0.5370 -6.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 2.4490 -7.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6480 2.3010 -8.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 3.2420 -7.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 4.6750 -8.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 4.5490 -8.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 2.9030 -10.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 4.2720 -11.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 2.1100 -11.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 3.0510 -10.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 0.6770 -9.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 0.8030 -9.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 -5.2230 -6.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -1.5470 -5.5090 N 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 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 69 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 21 69 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 22 69 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 56 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 30 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 31 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 32 68 1 0 0 0 0 M END