B6J1ND
-OEChem-04022105373D
42 43 0 0 0 0 0 0 0999 V2000
1.2710 1.4397 0.0552 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7983 -2.5596 -0.0810 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9253 1.5779 0.0958 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5993 1.5303 0.0333 N 0 0 0 0 0 0 0 0 0 0 0 0
4.8785 -0.4927 0.0009 N 0 0 0 0 0 0 0 0 0 0 0 0
-6.3494 0.6718 0.0237 N 0 0 0 0 0 0 0 0 0 0 0 0
2.4646 -0.6057 -0.0199 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3614 0.8710 0.0236 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7563 -1.3313 -0.0379 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8772 0.9244 0.0437 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0432 0.1413 0.0039 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4755 -0.8998 -0.0349 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3303 -1.3222 -0.0446 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9703 0.9450 -0.3817 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8234 -1.1867 0.3698 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5653 2.9908 0.0325 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1953 -1.1255 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6779 0.4210 -0.4012 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5308 -1.7107 0.3503 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1103 -1.4534 -0.0556 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0166 -0.7242 -0.0305 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.5662 2.0798 0.2913 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.4923 -0.1811 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3609 -2.4085 -0.0841 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1104 1.9770 -0.6911 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6352 -1.8353 0.6865 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5810 3.3853 -0.2315 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3050 3.3759 -0.6765 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8353 3.3371 1.0352 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7645 -0.7553 -0.8586 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1373 -2.2153 -0.0507 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7243 -0.8362 0.9142 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8850 1.0779 -0.7443 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3746 -2.7459 0.6418 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0483 -2.5378 -0.1259 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2010 0.3056 0.1315 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3813 2.6785 -0.6068 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9209 2.4386 1.1013 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.5990 2.2674 0.6057 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.2983 -0.8686 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3715 0.4104 -0.5162 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7552 -0.7605 0.6542 H 0 0 0 0 0 0 0 0 0 0 0 0
1 8 2 0 0 0 0
2 9 2 0 0 0 0
3 10 2 0 0 0 0
4 8 1 0 0 0 0
4 10 1 0 0 0 0
4 16 1 0 0 0 0
5 9 1 0 0 0 0
5 10 1 0 0 0 0
5 17 1 0 0 0 0
6 11 1 0 0 0 0
6 22 1 0 0 0 0
6 23 1 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 13 2 0 0 0 0
11 14 2 0 0 0 0
11 15 1 0 0 0 0
12 18 2 0 0 0 0
12 19 1 0 0 0 0
12 20 1 0 0 0 0
13 21 1 0 0 0 0
13 24 1 0 0 0 0
14 18 1 0 0 0 0
14 25 1 0 0 0 0
15 19 2 0 0 0 0
15 26 1 0 0 0 0
16 27 1 0 0 0 0
16 28 1 0 0 0 0
16 29 1 0 0 0 0
17 30 1 0 0 0 0
17 31 1 0 0 0 0
17 32 1 0 0 0 0
18 33 1 0 0 0 0
19 34 1 0 0 0 0
20 21 2 0 0 0 0
20 35 1 0 0 0 0
21 36 1 0 0 0 0
22 37 1 0 0 0 0
22 38 1 0 0 0 0
22 39 1 0 0 0 0
23 40 1 0 0 0 0
23 41 1 0 0 0 0
23 42 1 0 0 0 0
M END
$$$$