D0IC5F
-OEChem-04152111193D
58 63 0 1 0 0 0 0 0999 V2000
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0.1091 0.1888 1.2128 O 0 0 0 0 0 0 0 0 0 0 0 0
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2.2879 -0.2364 -0.6880 O 0 0 0 0 0 0 0 0 0 0 0 0
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0.4057 3.9709 -1.3116 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6766 -2.4073 0.0656 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.1615 -2.5979 0.1883 N 0 3 1 0 0 0 0 0 0 0 0 0
-2.1660 -0.5648 0.8708 C 0 0 1 0 0 0 0 0 0 0 0 0
-3.5843 -0.1770 0.4538 C 0 0 2 0 0 0 0 0 0 0 0 0
-4.0778 -1.2458 -0.5508 C 0 0 1 0 0 0 0 0 0 0 0 0
-1.2869 0.5023 1.5559 C 0 0 2 0 0 0 0 0 0 0 0 0
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-3.6900 1.2612 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0
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-1.6004 1.9736 1.1769 C 0 0 2 0 0 0 0 0 0 0 0 0
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0.0028 -0.4072 -0.0259 C 0 0 0 0 0 0 0 0 0 0 0 0
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1.0039 -0.5779 -0.9541 C 0 0 0 0 0 0 0 0 0 0 0 0
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3.0684 -1.2728 -0.1636 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4590 -0.8239 0.1017 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3894 -1.7141 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8351 0.4877 -0.1872 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6958 -1.2925 0.8856 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1414 0.9094 0.0602 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0718 0.0192 0.5966 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2246 -0.2057 1.3459 H 0 0 0 0 0 0 0 0 0 0 0 0
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-3.3434 -2.3915 -2.2807 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2327 2.5899 2.0045 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3122 3.2505 0.6753 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6094 2.0795 1.9331 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2319 -2.0621 1.9587 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2514 -2.4141 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4622 -3.7517 1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9571 -1.7369 -3.5166 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3974 -1.2213 -2.9784 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1165 -2.7402 0.8698 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1427 1.2125 -0.6057 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4204 -1.9854 1.3032 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4349 1.9307 -0.1646 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0889 0.3476 0.7893 H 0 0 0 0 0 0 0 0 0 0 0 0
1 3 1 0 0 0 0
1 5 1 0 0 0 0
1 6 2 0 0 0 0
1 7 2 0 0 0 0
2 13 1 0 0 0 0
2 22 1 0 0 0 0
3 19 1 0 0 0 0
4 25 1 0 0 0 0
4 27 1 0 0 0 0
8 27 2 0 0 0 0
9 12 1 0 0 0 0
9 17 1 0 0 0 0
9 23 1 0 0 0 0
9 39 1 0 0 0 0
10 11 1 0 0 0 0
10 13 1 0 0 0 0
10 14 1 0 0 0 0
10 15 1 0 0 0 0
11 12 1 0 0 0 0
11 16 1 0 0 0 0
11 34 1 0 0 0 0
12 18 1 0 0 0 0
12 35 1 0 0 0 0
13 19 1 0 0 0 0
13 36 1 0 0 0 0
14 17 1 0 0 0 0
14 37 1 0 0 0 0
14 38 1 0 0 0 0
15 21 2 0 0 0 0
15 22 1 0 0 0 0
16 20 1 0 0 0 0
16 40 1 0 0 0 0
16 41 1 0 0 0 0
17 42 1 0 0 0 0
17 43 1 0 0 0 0
18 21 1 0 0 0 0
18 44 1 0 0 0 0
18 45 1 0 0 0 0
19 20 1 0 0 0 0
19 46 1 0 0 0 0
20 47 1 0 0 0 0
20 48 1 0 0 0 0
21 24 1 0 0 0 0
22 25 2 0 0 0 0
23 49 1 0 0 0 0
23 50 1 0 0 0 0
23 51 1 0 0 0 0
24 26 2 0 0 0 0
24 52 1 0 0 0 0
25 26 1 0 0 0 0
26 53 1 0 0 0 0
27 28 1 0 0 0 0
28 29 2 0 0 0 0
28 30 1 0 0 0 0
29 31 1 0 0 0 0
29 54 1 0 0 0 0
30 32 2 0 0 0 0
30 55 1 0 0 0 0
31 33 2 0 0 0 0
31 56 1 0 0 0 0
32 33 1 0 0 0 0
32 57 1 0 0 0 0
33 58 1 0 0 0 0
M CHG 2 5 -1 9 1
M END
$$$$