B8W1MK
-OEChem-04012118282D
48 52 0 1 0 0 0 0 0999 V2000
6.7810 -3.4085 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
10.7590 -2.9904 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.8311 0.8456 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
8.9957 -0.5633 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.0274 3.3282 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.0274 3.3282 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.7029 2.1449 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.4189 0.0366 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
7.4134 0.1412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5944 -1.5814 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
8.0012 -0.6679 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.0121 -0.8769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5999 -1.6859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8370 0.8448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1391 1.7908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1822 -2.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5274 1.7894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3364 2.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7183 2.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7755 -3.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1767 -2.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7645 -3.0949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3633 -4.1130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3424 4.1130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.3578 -4.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3219 3.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6710 0.6030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9706 0.4129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2425 0.7371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2110 -1.5166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2534 -0.1015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4981 -0.5302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5814 -1.3229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0427 -1.9577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7708 -2.2819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2308 0.7147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9027 0.2283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7051 1.5378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4502 2.3271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2479 0.0031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3601 -1.0649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4289 -1.7195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1111 -4.6794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5408 4.7004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7222 -4.5100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3940 2.7824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9088 4.3666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 20 1 0 0 0 0
2 22 1 0 0 0 0
8 3 1 6 0 0 0
3 14 1 0 0 0 0
3 15 1 0 0 0 0
11 4 1 6 0 0 0
4 41 1 0 0 0 0
4 42 1 0 0 0 0
5 6 1 0 0 0 0
5 18 2 0 0 0 0
6 19 1 0 0 0 0
6 24 1 0 0 0 0
7 19 1 0 0 0 0
7 26 2 0 0 0 0
8 9 1 0 0 0 0
8 12 1 0 0 0 0
8 28 1 0 0 0 0
9 11 1 0 0 0 0
9 29 1 0 0 0 0
9 30 1 0 0 0 0
10 11 1 0 0 0 0
10 13 1 0 0 0 0
10 16 1 1 0 0 0
10 31 1 0 0 0 0
11 32 1 0 0 0 0
12 13 1 0 0 0 0
12 33 1 0 0 0 0
12 34 1 0 0 0 0
13 35 1 0 0 0 0
13 36 1 0 0 0 0
14 17 1 0 0 0 0
14 37 1 0 0 0 0
14 38 1 0 0 0 0
15 18 1 0 0 0 0
15 39 1 0 0 0 0
15 40 1 0 0 0 0
16 20 2 0 0 0 0
16 21 1 0 0 0 0
17 18 1 0 0 0 0
17 19 2 0 0 0 0
20 23 1 0 0 0 0
21 22 2 0 0 0 0
21 43 1 0 0 0 0
22 25 1 0 0 0 0
23 25 2 0 0 0 0
23 44 1 0 0 0 0
24 27 2 0 0 0 0
24 45 1 0 0 0 0
25 46 1 0 0 0 0
26 27 1 0 0 0 0
26 47 1 0 0 0 0
27 48 1 0 0 0 0
M END
$$$$