B87NKT
-OEChem-04022117573D
62 65 0 1 0 0 0 0 0999 V2000
0.7858 0.5448 0.4126 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5887 -3.4210 -1.4253 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0478 0.5643 2.4006 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.9202 2.8491 -0.3873 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5441 -0.3694 0.3175 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.4979 -3.4575 0.8680 N 0 0 0 0 0 0 0 0 0 0 0 0
-5.4780 1.7007 1.0108 N 0 0 0 0 0 0 0 0 0 0 0 0
2.1502 0.3502 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3670 -1.4614 -0.2084 C 0 0 2 0 0 0 0 0 0 0 0 0
-1.3936 -0.4877 0.4766 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0592 -0.3819 -0.2581 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7140 -1.5256 0.5298 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1421 0.0491 -1.4471 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8381 1.6951 0.3906 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6857 -0.8175 0.9254 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7784 -2.8665 -0.3454 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1090 1.0973 -2.3667 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1734 1.8973 0.0416 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9846 -1.2875 0.7313 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1677 -1.2714 -1.8955 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1239 2.7069 1.0319 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8701 -1.4019 1.8943 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6416 0.6202 1.3217 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2455 -0.2315 -0.8731 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1016 0.8251 -3.7348 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7944 3.1117 0.3339 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4680 -2.3419 1.5061 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1602 -1.5438 -3.2635 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7448 3.9212 1.3243 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3533 -2.4563 2.6691 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1272 -0.4955 -4.1831 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0801 4.1236 0.9753 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6523 -2.9263 2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0384 0.8044 -1.1553 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1979 1.8834 -0.1596 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5366 -1.1070 -1.2343 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8368 0.5152 0.5185 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2275 -0.7700 1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2894 -0.0299 -1.2707 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3437 -1.3952 -0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2823 -2.4073 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5479 -1.6663 1.6048 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0591 2.1370 -2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7501 1.1524 -0.4939 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6367 -0.8871 -0.0359 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1908 -2.1271 -1.2283 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0861 2.5986 1.3316 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8764 -1.0452 2.1309 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1184 -1.0330 -1.5936 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0689 1.6408 -4.4511 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8312 3.2732 0.0537 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4764 -2.7136 1.3496 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1786 -2.5719 -3.6132 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1896 4.7093 1.8247 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7229 -2.9039 3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1194 -0.7077 -5.2482 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5630 5.0698 1.2012 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0288 -3.7468 3.0788 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6590 -2.9965 1.7572 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1065 -4.3927 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5647 2.4252 1.7181 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.5713 0.8793 -2.0951 H 0 0 0 0 0 0 0 0 0 0 0 0
1 8 1 0 0 0 0
1 11 1 0 0 0 0
2 16 2 0 0 0 0
3 23 2 0 0 0 0
4 35 2 0 0 0 0
5 12 1 0 0 0 0
5 23 1 0 0 0 0
5 24 1 0 0 0 0
6 16 1 0 0 0 0
6 59 1 0 0 0 0
6 60 1 0 0 0 0
7 23 1 0 0 0 0
7 35 1 0 0 0 0
7 61 1 0 0 0 0
8 13 1 0 0 0 0
8 14 1 0 0 0 0
8 15 1 0 0 0 0
9 10 1 0 0 0 0
9 12 1 0 0 0 0
9 16 1 0 0 0 0
9 36 1 0 0 0 0
10 11 1 0 0 0 0
10 37 1 0 0 0 0
10 38 1 0 0 0 0
11 39 1 0 0 0 0
11 40 1 0 0 0 0
12 41 1 0 0 0 0
12 42 1 0 0 0 0
13 17 2 0 0 0 0
13 20 1 0 0 0 0
14 18 2 0 0 0 0
14 21 1 0 0 0 0
15 19 2 0 0 0 0
15 22 1 0 0 0 0
17 25 1 0 0 0 0
17 43 1 0 0 0 0
18 26 1 0 0 0 0
18 44 1 0 0 0 0
19 27 1 0 0 0 0
19 45 1 0 0 0 0
20 28 2 0 0 0 0
20 46 1 0 0 0 0
21 29 2 0 0 0 0
21 47 1 0 0 0 0
22 30 2 0 0 0 0
22 48 1 0 0 0 0
24 34 2 0 0 0 0
24 49 1 0 0 0 0
25 31 2 0 0 0 0
25 50 1 0 0 0 0
26 32 2 0 0 0 0
26 51 1 0 0 0 0
27 33 2 0 0 0 0
27 52 1 0 0 0 0
28 31 1 0 0 0 0
28 53 1 0 0 0 0
29 32 1 0 0 0 0
29 54 1 0 0 0 0
30 33 1 0 0 0 0
30 55 1 0 0 0 0
31 56 1 0 0 0 0
32 57 1 0 0 0 0
33 58 1 0 0 0 0
34 35 1 0 0 0 0
34 62 1 0 0 0 0
M END
$$$$