IBS-ZINC02440886 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 0.0070 1.1710 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -0.2020 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -1.0080 1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -2.2250 0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -2.4030 -0.5740 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -0.8640 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -0.3970 -2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -1.1250 -3.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -0.5680 -4.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 0.5500 -5.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -1.6670 -5.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -1.7410 -7.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -2.9570 -7.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -4.0470 -6.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -3.9620 -5.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -2.7450 -4.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -2.4450 -3.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -5.1110 -4.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -6.7080 -2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -7.0540 -1.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -5.8430 -1.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -6.0500 -0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -6.5010 -4.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 -7.7420 -5.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 -8.8420 -4.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -10.0370 -5.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -5.2360 -7.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 1.9120 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 1.2310 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 1.4370 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -0.7010 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -3.0130 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 0.6480 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -0.8920 -7.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -3.0450 -8.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -4.7230 -3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -5.8590 -5.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -7.5770 -3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -6.0920 -2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 -7.4560 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -7.7970 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 -6.3710 0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 -6.7940 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2130 -5.1030 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4230 -6.7520 -4.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 -5.7420 -5.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -7.5710 -6.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -7.9960 -6.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -9.9070 -5.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -10.3190 -6.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -10.8370 -4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -5.1190 -8.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -5.8350 -3.9510 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0330 -5.1160 -3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END