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1oir
XXCombChem01180512423D 0.00000
31 34 0 0 0 0 0 0 0 0999 V2000
-1.6176 30.4574 10.7650 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3322 29.1160 10.2559 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5531 28.7491 9.1633 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1563 29.6260 8.2902 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3121 29.1723 7.6774 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0490 29.9340 6.8319 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1984 29.4691 6.2512 N 0 0 0 0 0 0 0 0 0 0 0 0
3.8827 28.2302 6.2795 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0737 27.9925 5.5621 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7153 26.7376 5.6385 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1958 25.7139 6.4484 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0110 25.9606 7.1825 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3632 27.2066 7.0894 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8349 24.6145 6.4664 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6924 23.4262 7.0823 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5555 22.2866 6.0249 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6974 22.2661 5.1619 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4137 20.8628 6.6710 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4042 19.7624 5.6649 N 0 0 0 0 0 0 0 0 0 0 0 0
5.3549 18.4308 6.2992 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6124 19.7405 4.8021 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6315 31.2048 6.5691 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5315 31.7213 7.1278 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2599 30.9524 7.9973 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8406 28.0147 10.8171 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.4033 26.9706 10.0931 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6010 27.3951 9.0937 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0269 26.5170 8.2306 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2688 25.1408 8.3635 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1082 24.6825 9.4185 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6993 25.6116 10.3084 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 0
3 27 1 0
3 4 1 0
4 24 1 0
4 5 2 0
5 6 1 0
6 7 1 0
7 8 1 0
8 13 1 0
8 9 2 0
9 10 1 0
10 11 2 0
11 12 1 0
12 13 2 0
11 14 1 0
14 15 1 0
15 16 1 0
16 17 1 0
16 18 1 0
18 19 1 0
19 20 1 0
19 21 1 0
6 22 2 0
22 23 1 0
23 24 2 0
2 25 1 0
25 26 2 0
26 31 1 0
26 27 1 0
27 28 1 0
28 29 2 0
29 30 1 0
30 31 2 0
M END
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