BJ7N4T
-OEChem-04042103593D
41 43 0 1 0 0 0 0 0999 V2000
1.1113 0.7048 1.3848 S 0 0 0 0 0 0 0 0 0 0 0 0
4.5987 -3.0575 0.7608 F 0 0 0 0 0 0 0 0 0 0 0 0
3.6552 -0.7295 -0.3734 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2749 1.6819 2.4444 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6012 -0.6504 1.5498 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0263 -2.6984 -0.8185 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.6934 -1.6345 -0.9025 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7081 1.3453 -0.0720 N 0 0 1 0 0 0 0 0 0 0 0 0
-4.6307 0.2445 0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0
1.7690 0.4420 -1.2661 C 0 0 1 0 0 0 0 0 0 0 0 0
1.2073 1.2784 -2.4188 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1916 2.6727 -0.5044 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4771 2.7107 -1.9964 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2173 0.0280 -1.4897 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6127 0.6097 1.0084 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1293 -0.5528 0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4473 1.7100 1.2962 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4803 -0.5638 0.1621 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3114 0.5164 0.4423 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0064 -1.1482 -0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8168 1.6710 1.0121 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3284 -1.5976 -0.4272 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7420 -1.0234 -0.4682 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4003 -1.9593 0.6931 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1617 -0.4561 -1.1302 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1241 1.1195 -2.4932 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6487 1.0342 -3.3895 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7139 3.4769 0.0209 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1194 2.7858 -0.3594 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5265 2.9705 -2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8489 3.4333 -2.5248 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8619 0.9079 -1.6057 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2929 -0.5821 -2.3976 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5139 -1.4153 0.2056 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0428 2.6111 1.7509 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6595 -0.2740 -0.6149 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0941 -1.7684 -1.4198 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4552 2.5180 1.2355 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3930 0.9009 0.1934 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4381 -2.2966 0.6315 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2519 -1.3925 1.6166 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 8 1 0 0 0 0
1 15 1 0 0 0 0
2 24 1 0 0 0 0
3 14 1 0 0 0 0
3 20 1 0 0 0 0
6 22 2 0 0 0 0
7 23 2 0 0 0 0
8 10 1 0 0 0 0
8 12 1 0 0 0 0
9 19 1 0 0 0 0
9 23 1 0 0 0 0
9 39 1 0 0 0 0
10 11 1 0 0 0 0
10 14 1 0 0 0 0
10 25 1 0 0 0 0
11 13 1 0 0 0 0
11 26 1 0 0 0 0
11 27 1 0 0 0 0
12 13 1 0 0 0 0
12 28 1 0 0 0 0
12 29 1 0 0 0 0
13 30 1 0 0 0 0
13 31 1 0 0 0 0
14 32 1 0 0 0 0
14 33 1 0 0 0 0
15 16 2 0 0 0 0
15 17 1 0 0 0 0
16 18 1 0 0 0 0
16 34 1 0 0 0 0
17 21 2 0 0 0 0
17 35 1 0 0 0 0
18 19 2 0 0 0 0
18 22 1 0 0 0 0
19 21 1 0 0 0 0
20 24 1 0 0 0 0
20 36 1 0 0 0 0
20 37 1 0 0 0 0
21 38 1 0 0 0 0
22 23 1 0 0 0 0
24 40 1 0 0 0 0
24 41 1 0 0 0 0
M END
$$$$