MMs00027073 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 1.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5181 2.5876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0181 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7409 1.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2409 1.3147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9818 2.6189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0209 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0313 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8999 -1.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2408 1.3356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7408 1.3460 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4998 0.0522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7589 -1.2520 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.9589 -1.2520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2589 -1.2625 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8589 -2.3017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 -2.5667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5179 -2.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0346 2.1050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0241 3.6050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3388 1.3641 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6326 2.1231 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6326 0.9231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6221 3.6231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9159 4.3821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2202 3.6412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2306 2.1412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9368 1.3822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9473 -0.1178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7303 2.8460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2771 3.8814 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 1.2729 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.6072 -1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0927 -1.0538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5747 3.6414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4072 -1.0225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1104 1.7381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4410 2.5188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4137 0.8299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4244 -0.7127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1252 -3.6017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9252 -3.5892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3472 0.1641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4419 3.4065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2039 4.7478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1382 5.2960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6809 5.3067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6227 4.7716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4034 3.4410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2740 1.5485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6870 3.4387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 31 2 0 0 0 0 32 53 1 0 0 0 0 M END