B1U8EA
-OEChem-04022115333D
53 56 0 1 0 0 0 0 0999 V2000
4.9690 2.0923 0.5153 O 0 0 0 0 0 0 0 0 0 0 0 0
6.1501 -0.3174 -0.2003 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2212 -1.1803 -0.0578 N 0 0 2 0 0 0 0 0 0 0 0 0
-2.1849 2.5124 -0.6468 N 0 0 0 0 0 0 0 0 0 0 0 0
-4.1569 0.1573 1.3260 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4892 0.0117 0.4693 C 0 0 2 0 0 0 0 0 0 0 0 0
-2.3535 0.0537 -0.3243 C 0 0 1 0 0 0 0 0 0 0 0 0
-0.1344 1.2626 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6438 1.3629 0.0837 C 0 0 1 0 0 0 0 0 0 0 0 0
-1.6440 -1.1607 0.3081 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4145 -2.4168 0.4046 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0035 -0.0626 0.2677 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7952 -2.5351 -0.2361 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6198 -1.2906 -0.0443 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8364 0.0369 0.0182 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8232 1.0597 0.4753 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0109 -1.3595 -0.2148 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7674 -0.0979 -0.9993 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2083 0.9796 0.3164 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8014 -0.2274 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1138 -0.1099 -0.6521 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.4752 0.1414 1.6252 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4829 0.0114 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.1574 -0.2527 -1.7067 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2113 2.9223 -0.6189 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6755 -1.5932 -0.5633 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3330 0.0714 1.5567 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2549 -0.0519 -1.4159 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0549 1.2393 -1.2742 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3381 2.1777 0.1844 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7895 1.5437 1.1568 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7617 -1.1600 1.4004 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1312 -2.0728 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1722 -3.2932 0.1026 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4893 -2.4366 1.5001 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3113 -3.3974 0.2027 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6928 -2.7193 -1.3132 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1677 2.6409 -0.4105 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7071 3.3625 -0.3503 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3925 2.0107 0.7766 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4146 -2.3314 -0.4803 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4618 -0.1898 -2.0366 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7101 0.2398 2.6799 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.5234 0.0075 0.9892 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0656 -0.7163 -1.3066 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8056 -0.8911 -2.5243 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4171 0.7295 -2.1139 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7428 2.3660 -1.3975 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2693 3.3154 -1.0143 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8351 3.7624 -0.3017 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5016 -2.3389 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3048 -1.9196 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7605 -1.4792 -0.6574 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 1 0 0 0 0
1 25 1 0 0 0 0
2 20 1 0 0 0 0
2 26 1 0 0 0 0
3 6 1 0 0 0 0
3 10 1 0 0 0 0
3 11 1 0 0 0 0
4 9 1 0 0 0 0
4 38 1 0 0 0 0
4 39 1 0 0 0 0
5 15 2 0 0 0 0
5 22 1 0 0 0 0
6 8 1 0 0 0 0
6 12 1 0 0 0 0
6 27 1 0 0 0 0
7 9 1 0 0 0 0
7 10 1 0 0 0 0
7 15 1 0 0 0 0
7 28 1 0 0 0 0
8 9 1 0 0 0 0
8 29 1 0 0 0 0
8 30 1 0 0 0 0
9 31 1 0 0 0 0
10 32 1 0 0 0 0
10 33 1 0 0 0 0
11 13 1 0 0 0 0
11 34 1 0 0 0 0
11 35 1 0 0 0 0
12 14 1 0 0 0 0
12 16 2 0 0 0 0
13 14 1 0 0 0 0
13 36 1 0 0 0 0
13 37 1 0 0 0 0
14 17 2 0 0 0 0
15 18 1 0 0 0 0
16 19 1 0 0 0 0
16 40 1 0 0 0 0
17 20 1 0 0 0 0
17 41 1 0 0 0 0
18 21 2 0 0 0 0
18 42 1 0 0 0 0
19 20 2 0 0 0 0
21 23 1 0 0 0 0
21 24 1 0 0 0 0
22 23 2 0 0 0 0
22 43 1 0 0 0 0
23 44 1 0 0 0 0
24 45 1 0 0 0 0
24 46 1 0 0 0 0
24 47 1 0 0 0 0
25 48 1 0 0 0 0
25 49 1 0 0 0 0
25 50 1 0 0 0 0
26 51 1 0 0 0 0
26 52 1 0 0 0 0
26 53 1 0 0 0 0
M END
$$$$