BI7B0S
-OEChem-04022104293D
43 46 0 0 0 0 0 0 0999 V2000
1.0361 -2.0987 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1694 0.2447 -0.1014 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.0904 -0.3553 -0.0302 N 0 0 0 0 0 0 0 0 0 0 0 0
-4.4947 -0.7850 0.6738 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.4947 2.0006 -0.1269 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8605 2.3516 -0.1101 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1783 0.6413 -0.0851 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8207 1.3347 -0.0532 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3877 0.0181 -0.0157 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4844 3.0062 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2177 3.7093 -0.1511 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3325 -1.0719 0.0457 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1600 -1.1516 -0.0669 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1117 4.3497 -0.2242 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2363 4.7004 -0.2077 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6768 -1.0544 -0.0661 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8961 -0.1064 0.4506 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2878 -0.1985 0.4502 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7517 -2.2846 -0.5847 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0344 -2.3059 -0.5092 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9116 -1.3335 -0.0677 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1435 -2.3766 -0.5851 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1094 0.9165 1.0038 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9909 -3.3105 -0.4136 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.4003 -1.7863 0.7473 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1991 -3.0539 0.2253 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8775 1.5889 -0.0494 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5507 2.8098 -0.1955 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2642 4.0067 -0.1391 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8458 0.9869 -0.2096 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8726 5.1237 -0.2671 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5249 5.7471 -0.2386 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4435 0.7700 0.9038 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1690 -3.1031 -0.9967 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0977 -2.5109 -1.0173 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9950 -1.4187 -0.0726 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6293 -3.2600 -0.9893 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6593 1.8874 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1925 0.8181 2.0908 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1180 0.9198 0.5768 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7964 -4.2911 -0.8377 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3258 -1.5352 1.2549 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9593 -3.8217 0.3112 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 2 0 0 0 0
2 7 1 0 0 0 0
2 16 1 0 0 0 0
2 30 1 0 0 0 0
3 7 2 0 0 0 0
3 9 1 0 0 0 0
4 12 1 0 0 0 0
4 25 2 0 0 0 0
5 6 1 0 0 0 0
5 7 1 0 0 0 0
5 10 2 0 0 0 0
6 8 1 0 0 0 0
6 11 2 0 0 0 0
8 9 2 0 0 0 0
8 27 1 0 0 0 0
9 12 1 0 0 0 0
10 14 1 0 0 0 0
10 28 1 0 0 0 0
11 15 1 0 0 0 0
11 29 1 0 0 0 0
12 20 2 0 0 0 0
13 16 1 0 0 0 0
13 17 1 0 0 0 0
13 19 2 0 0 0 0
14 15 2 0 0 0 0
14 31 1 0 0 0 0
15 32 1 0 0 0 0
17 18 2 0 0 0 0
17 33 1 0 0 0 0
18 21 1 0 0 0 0
18 23 1 0 0 0 0
19 22 1 0 0 0 0
19 34 1 0 0 0 0
20 24 1 0 0 0 0
20 35 1 0 0 0 0
21 22 2 0 0 0 0
21 36 1 0 0 0 0
22 37 1 0 0 0 0
23 38 1 0 0 0 0
23 39 1 0 0 0 0
23 40 1 0 0 0 0
24 26 2 0 0 0 0
24 41 1 0 0 0 0
25 26 1 0 0 0 0
25 42 1 0 0 0 0
26 43 1 0 0 0 0
M END
$$$$