1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21
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Marvin 05311006113D
8 7 0 0 0 0 999 V2000
2.4385 -1.2191 0.5553 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3744 -1.5499 -0.3691 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0035 -0.9997 0.5036 P 0 0 0 0 0 0 0 0 0 0 0 0
-0.6595 -2.3554 0.0412 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0778 -2.2837 -0.0365 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2499 -0.1518 -0.2246 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8159 0.3834 0.5707 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0139 -1.2455 1.8452 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
6 3 1 0 0 0 0
7 3 1 0 0 0 0
3 8 1 0 0 0 0
M END
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