MMs00269947 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 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 -0.7424 -1.3034 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2424 -1.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9848 -2.6155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2273 -3.9101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9697 -5.2135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7273 -3.9014 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1213 -4.9371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0151 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5151 -2.5893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4538 -2.3122 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6193 -0.8213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2526 -0.2033 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9227 -0.0789 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9314 1.4211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2348 2.1635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2435 3.6635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5627 -3.3223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9920 -2.8671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3124 -1.4017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7416 -0.9465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8505 -1.9567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5301 -3.4221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1008 -3.8773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7804 -5.3427 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0427 -0.5939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5939 1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0427 0.5939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7485 1.2196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5276 2.5511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6387 1.0335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4178 2.3650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2862 4.2574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6128 -4.0556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1199 -4.3851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4253 -0.5936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9979 0.2258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9939 -1.5925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4172 -4.2302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 M END