IBS-ZINC01870239 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0220 -0.6490 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.0300 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7420 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.0170 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6360 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.2230 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -4.8360 1.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.8900 -1.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -6.3550 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -6.8580 -2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -8.3220 -2.6530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -8.9900 -3.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -8.3770 -4.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -10.4710 -3.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -11.1830 -5.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -12.5640 -4.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -13.2090 -3.8470 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1450 -12.5760 -2.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -11.1960 -2.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -14.6740 -3.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.0900 2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -2.5510 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.5280 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.0680 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -4.4010 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -6.7090 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -6.7330 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -6.5040 -3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -6.4790 -3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -8.8120 -1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -10.6620 -5.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -13.1230 -5.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -13.1450 -1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -10.6840 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -15.0230 -3.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -15.0480 -2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -15.0390 -4.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 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 28 1 0 0 0 0 7 29 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 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 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 16 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 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M CHG 1 2 1 M CHG 1 19 1 M END