B8R6TU
-OEChem-04022116033D
34 36 0 0 0 0 0 0 0999 V2000
0.2035 2.1510 -0.0003 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7539 -2.4781 0.0072 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.9069 -0.1691 0.0038 O 0 5 0 0 0 0 0 0 0 0 0 0
-5.0584 1.8549 -0.0416 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9877 -0.1030 0.0025 N 0 0 0 0 0 0 0 0 0 0 0 0
-4.9226 0.6082 -0.0140 N 0 3 0 0 0 0 0 0 0 0 0 0
2.4111 0.0661 -0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2549 0.3253 -0.0087 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0918 -1.0453 0.0246 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0694 0.9407 -0.0163 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3398 -1.3330 0.0251 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1124 0.1713 1.2047 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1111 0.1284 -1.2109 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5052 0.9118 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1697 -1.9084 0.0426 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4973 0.3370 1.2011 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4962 0.2940 -1.2144 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6123 0.0592 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4460 -1.3392 0.0294 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3993 0.1100 2.5168 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3968 0.0198 -2.5192 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1892 0.3983 -0.0084 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5962 1.9925 -0.0443 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0414 -2.9844 0.0658 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0534 0.4201 2.1312 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0514 0.3439 -2.1473 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2991 -2.0140 0.0439 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6748 0.9266 2.5995 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8815 -0.8481 2.6291 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0913 0.2045 3.3610 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8824 -0.9435 -2.5980 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6691 0.8303 -2.6287 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0873 0.0881 -3.3669 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2677 0.5273 -0.0112 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 2 0 0 0 0
2 11 2 0 0 0 0
3 6 1 0 0 0 0
4 6 2 0 0 0 0
5 7 1 0 0 0 0
5 10 1 0 0 0 0
5 11 1 0 0 0 0
6 18 1 0 0 0 0
7 12 2 0 0 0 0
7 13 1 0 0 0 0
8 9 2 0 0 0 0
8 10 1 0 0 0 0
8 14 1 0 0 0 0
9 11 1 0 0 0 0
9 15 1 0 0 0 0
12 16 1 0 0 0 0
12 20 1 0 0 0 0
13 17 2 0 0 0 0
13 21 1 0 0 0 0
14 18 2 0 0 0 0
14 23 1 0 0 0 0
15 19 2 0 0 0 0
15 24 1 0 0 0 0
16 22 2 0 0 0 0
16 25 1 0 0 0 0
17 22 1 0 0 0 0
17 26 1 0 0 0 0
18 19 1 0 0 0 0
19 27 1 0 0 0 0
20 28 1 0 0 0 0
20 29 1 0 0 0 0
20 30 1 0 0 0 0
21 31 1 0 0 0 0
21 32 1 0 0 0 0
21 33 1 0 0 0 0
22 34 1 0 0 0 0
M CHG 2 3 -1 6 1
M END
$$$$