MMs00541007 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 38 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 -1.4999 -0.0123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2606 1.2805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5213 2.5857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0213 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7393 1.3052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2393 1.3175 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2606 -1.2805 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 0.0370 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2605 -1.2559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7604 -1.2436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5211 -2.5364 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0210 -2.5241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7817 -3.8169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2816 -3.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0209 -2.4994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2603 -1.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5209 -2.4871 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 14.2602 -1.1819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2815 -3.7799 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.7605 1.2682 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6085 -1.0343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0914 -1.0564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1298 3.6199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5701 3.6421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8307 2.3616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0913 1.0811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1363 -1.6755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4786 -2.4359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5424 -0.0635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8847 -0.8239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9296 -3.5805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1902 -4.8610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8901 -4.8388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8517 -0.1625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7603 -1.2189 0.0000 N 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 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 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 37 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END