MMs03458912 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 -0.8641 -1.2261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -2.4268 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3194 -3.5733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4547 -1.9428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4331 -0.4429 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3639 -1.2477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1326 0.0404 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7326 1.0796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4014 1.3501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 2.6382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6324 0.0188 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 -5.3636 -1.2910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8635 -1.3126 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 -7.5947 -2.6223 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1947 -3.6615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0945 -2.6439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8632 -1.3558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3570 -1.2205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6900 0.2420 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4019 1.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2729 0.0232 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1028 0.2895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8260 -3.9104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5572 -5.2201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3872 1.1358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4356 -2.6340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1386 -2.4264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4855 -1.6744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2302 -1.6851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5550 -2.4756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8691 -3.8226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2161 -3.0705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1471 -2.1238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2937 2.2058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9015 1.3717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3262 -3.8888 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7113 -4.9192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3166 2.4195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 24 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 24 37 1 0 0 0 0 36 39 1 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 12 -1 M CHG 1 14 -1 M END