IBS-ZINC02250298 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -4.1230 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 -4.6300 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9440 -4.8940 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2030 -5.3620 -0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2080 -5.3770 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 -4.9140 1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6290 -4.8230 2.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5340 -5.1700 3.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2360 -5.0810 4.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1730 -5.4400 5.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4290 -5.8970 5.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7540 -5.9970 3.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8130 -5.6360 2.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1120 -5.7180 1.6590 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1490 -5.7020 -1.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2550 -6.1120 -1.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7940 -5.5590 -2.9980 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5600 -5.1020 -3.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 -4.7840 -2.4150 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7460 -5.9010 -4.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5760 -4.6670 -4.4150 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.0470 -4.2560 -3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6460 -5.0250 -5.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7060 -3.7800 -6.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6650 -2.8160 -5.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7470 -3.6700 -5.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.2420 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -2.2320 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -4.4740 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -4.4840 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -4.7280 5.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9390 -5.3700 6.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1540 -6.1760 6.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7310 -6.3530 3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3000 -4.9970 -4.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2020 -6.2400 -4.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4060 -6.6960 -3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3410 -5.9020 -6.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6110 -5.1960 -4.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4300 -4.0410 -7.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7000 -3.3340 -6.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1410 -2.2740 -6.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1490 -2.1190 -5.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 2 0 0 0 0 12 13 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 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 31 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 M END