BK6AR1
-OEChem-04012118212D
54 58 0 1 0 0 0 0 0999 V2000
6.3849 0.4003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3621 -2.5934 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
3.4660 -1.7536 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.5532 -0.7574 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
2.0000 -1.4955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0872 -0.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4144 -1.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6054 0.3071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5189 -0.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4318 -3.5910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3324 -2.8354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3849 1.4003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4840 1.8342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2859 1.8342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2615 2.8092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5084 2.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7314 1.1141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0385 1.1140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8850 3.5910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8850 3.5910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2710 3.1315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4990 3.1315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7337 1.4134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0362 1.4134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5020 2.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2680 2.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4190 -1.1354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3650 -0.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3842 -1.4235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9102 -2.1089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1769 0.1142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4714 -0.4273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5270 -1.7039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0339 -1.0700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9236 0.8392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1153 0.6869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0389 -0.4373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8133 -3.6342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4751 -4.2095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0503 -3.5477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1824 -3.4369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9340 -2.9853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4824 -2.2338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9099 1.0705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8764 0.5112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8935 0.5112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6160 4.1496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1540 4.1496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1400 3.7375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6299 3.7375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2809 0.9900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4890 0.9899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9102 2.6140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8597 2.6139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 12 1 0 0 0 0
2 3 1 0 0 0 0
2 4 1 0 0 0 0
2 10 1 0 0 0 0
2 11 1 0 0 0 0
3 5 1 0 0 0 0
3 7 1 0 0 0 0
3 27 1 0 0 0 0
4 6 1 0 0 0 0
4 8 1 0 0 0 0
4 28 1 0 0 0 0
5 6 1 0 0 0 0
5 29 1 0 0 0 0
5 30 1 0 0 0 0
6 31 1 0 0 0 0
6 32 1 0 0 0 0
7 9 1 0 0 0 0
7 33 1 0 0 0 0
7 34 1 0 0 0 0
8 9 1 0 0 0 0
8 35 1 0 0 0 0
8 36 1 0 0 0 0
9 37 1 0 0 0 0
10 38 1 0 0 0 0
10 39 1 0 0 0 0
10 40 1 0 0 0 0
11 41 1 0 0 0 0
11 42 1 0 0 0 0
11 43 1 0 0 0 0
12 13 1 0 0 0 0
12 14 1 0 0 0 0
12 44 1 0 0 0 0
13 15 1 0 0 0 0
13 17 2 0 0 0 0
14 16 1 0 0 0 0
14 18 2 0 0 0 0
15 19 1 0 0 0 0
15 21 2 0 0 0 0
16 20 1 0 0 0 0
16 22 2 0 0 0 0
17 23 1 0 0 0 0
17 45 1 0 0 0 0
18 24 1 0 0 0 0
18 46 1 0 0 0 0
19 20 2 0 0 0 0
19 47 1 0 0 0 0
20 48 1 0 0 0 0
21 25 1 0 0 0 0
21 49 1 0 0 0 0
22 26 1 0 0 0 0
22 50 1 0 0 0 0
23 25 2 0 0 0 0
23 51 1 0 0 0 0
24 26 2 0 0 0 0
24 52 1 0 0 0 0
25 53 1 0 0 0 0
26 54 1 0 0 0 0
M CHG 1 2 1
M END
$$$$