BJX30T
-OEChem-04042101453D
42 45 0 0 0 0 0 0 0999 V2000
2.5597 2.7912 1.2471 S 0 0 0 0 0 0 0 0 0 0 0 0
-1.7067 -3.0363 1.3790 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0550 2.5352 -1.8159 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2269 1.6861 2.1245 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2620 4.1581 1.6300 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0107 0.5268 -1.2572 N 0 0 0 0 0 0 0 0 0 0 0 0
1.9115 2.5167 -0.3048 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0744 -0.6856 -0.5873 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1759 -1.0416 0.1014 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9258 -1.7579 -0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3406 -0.1748 0.1838 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2272 0.8581 -1.9855 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3862 -2.7816 0.2914 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2866 1.0587 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9522 -2.3790 0.6937 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0636 1.4458 -1.2444 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3414 1.3187 -1.0608 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2102 -1.9325 -0.9825 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5015 -0.5108 0.8908 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0452 -3.9593 0.6023 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3778 1.9373 -0.4406 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9092 -3.1136 -0.6882 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3310 -4.1196 0.0983 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5876 0.3667 0.9317 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5259 1.5880 0.2675 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3007 2.7055 0.8956 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5080 0.0324 -2.6442 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0024 1.6825 -2.6749 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6237 0.5483 -0.3427 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2248 1.5773 -1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7229 -1.2238 -1.6154 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5904 -1.4531 1.4224 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5857 -4.7288 1.2116 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3532 2.8962 -0.9509 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7746 3.3456 -0.8981 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9133 -3.2534 -1.0809 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8902 -5.0259 0.3122 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4826 0.0943 1.4838 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3718 2.2684 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5417 3.4256 0.1114 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5687 1.6907 0.5985 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8376 2.9683 1.8102 H 0 0 0 0 0 0 0 0 0 0 0 0
1 4 2 0 0 0 0
1 5 2 0 0 0 0
1 7 1 0 0 0 0
1 26 1 0 0 0 0
2 15 2 0 0 0 0
3 16 2 0 0 0 0
6 8 1 0 0 0 0
6 12 1 0 0 0 0
6 16 1 0 0 0 0
7 17 1 0 0 0 0
7 35 1 0 0 0 0
8 9 2 0 0 0 0
8 10 1 0 0 0 0
9 11 1 0 0 0 0
9 15 1 0 0 0 0
10 13 1 0 0 0 0
10 18 2 0 0 0 0
11 14 1 0 0 0 0
11 19 2 0 0 0 0
12 17 1 0 0 0 0
12 27 1 0 0 0 0
12 28 1 0 0 0 0
13 15 1 0 0 0 0
13 20 2 0 0 0 0
14 16 1 0 0 0 0
14 21 2 0 0 0 0
17 29 1 0 0 0 0
17 30 1 0 0 0 0
18 22 1 0 0 0 0
18 31 1 0 0 0 0
19 24 1 0 0 0 0
19 32 1 0 0 0 0
20 23 1 0 0 0 0
20 33 1 0 0 0 0
21 25 1 0 0 0 0
21 34 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
24 25 2 0 0 0 0
24 38 1 0 0 0 0
25 39 1 0 0 0 0
26 40 1 0 0 0 0
26 41 1 0 0 0 0
26 42 1 0 0 0 0
M END
$$$$