B4XIA7
-OEChem-04012112432D
38 41 0 0 0 0 0 0 0999 V2000
4.5106 -3.6272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.3255 0.1844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3984 3.0376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6782 -0.3508 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.0091 -1.0940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3181 -2.0450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0150 -1.0966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2962 -2.2529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3692 0.6002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7086 -2.0422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9654 -1.5098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5124 -2.6272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6564 -0.5587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0383 1.3434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3334 -0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6028 -3.2484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6994 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9875 -1.7106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7293 2.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3191 -0.5254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.5104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6200 -3.4728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3170 -2.6988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9875 1.0888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8218 0.3092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4200 0.8548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5858 1.6344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5313 0.2705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1826 -3.7044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5152 -2.8660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3970 -1.2451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3476 2.7830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1819 2.0034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9056 -0.0634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3942 -1.6422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8093 -4.0632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9239 -2.8253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2068 3.6272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 12 2 0 0 0 0
2 13 2 0 0 0 0
3 19 1 0 0 0 0
3 38 1 0 0 0 0
4 5 1 0 0 0 0
4 9 1 0 0 0 0
4 13 1 0 0 0 0
5 6 2 0 0 0 0
5 7 1 0 0 0 0
6 8 1 0 0 0 0
6 12 1 0 0 0 0
7 10 1 0 0 0 0
7 15 2 0 0 0 0
8 11 1 0 0 0 0
8 16 2 0 0 0 0
9 14 1 0 0 0 0
9 24 1 0 0 0 0
9 25 1 0 0 0 0
10 12 1 0 0 0 0
10 17 2 0 0 0 0
11 13 1 0 0 0 0
11 18 2 0 0 0 0
14 19 1 0 0 0 0
14 26 1 0 0 0 0
14 27 1 0 0 0 0
15 20 1 0 0 0 0
15 28 1 0 0 0 0
16 22 1 0 0 0 0
16 29 1 0 0 0 0
17 21 1 0 0 0 0
17 30 1 0 0 0 0
18 23 1 0 0 0 0
18 31 1 0 0 0 0
19 32 1 0 0 0 0
19 33 1 0 0 0 0
20 21 2 0 0 0 0
20 34 1 0 0 0 0
21 35 1 0 0 0 0
22 23 2 0 0 0 0
22 36 1 0 0 0 0
23 37 1 0 0 0 0
M END
$$$$