B2ALG5
-OEChem-04012113483D
43 46 0 0 0 0 0 0 0999 V2000
3.9380 1.8001 -1.1518 N 0 0 0 0 0 0 0 0 0 0 0 0
-4.7678 -1.4576 -0.4426 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5041 0.6151 -0.8694 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.8390 1.3881 2.4594 N 0 0 0 0 0 0 0 0 0 0 0 0
4.8089 -2.1305 0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0
2.6364 -2.1137 0.7240 N 0 0 0 0 0 0 0 0 0 0 0 0
4.3954 -3.2759 0.6461 N 0 0 0 0 0 0 0 0 0 0 0 0
3.1148 -3.3109 1.0399 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2878 1.2454 0.6117 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0608 1.4595 0.1298 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2911 0.7333 -0.2024 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5691 0.5480 0.3132 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3061 0.6589 -0.2332 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6197 1.8917 -0.7946 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0037 0.4299 0.2406 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6838 0.0030 -0.5109 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4026 2.6881 -0.4383 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6949 2.9313 -0.9148 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5082 -0.0767 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6091 1.5544 1.9230 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0106 0.3785 -1.6293 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7893 0.8879 1.6382 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8600 -1.9478 -1.2674 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6728 -1.4377 0.1582 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9586 -3.4625 -1.2045 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7216 -0.5201 0.6844 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6276 0.4397 -0.1556 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5934 0.3380 -1.5512 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3371 3.4826 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9623 3.8847 -1.3566 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8717 1.9577 2.6114 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9475 0.3248 -1.8768 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4098 -0.6116 -1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4616 1.1221 -2.2952 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7641 0.7651 2.1006 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5100 2.5102 -1.5916 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9161 -1.7469 0.5243 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8137 -1.5194 -0.9366 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7059 -1.6540 -2.3123 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0345 -3.9335 -1.5562 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1503 -3.8050 -0.1819 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7792 -3.8150 -1.8375 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0155 -4.0698 0.7655 H 0 0 0 0 0 0 0 0 0 0 0 0
1 3 1 0 0 0 0
1 14 1 0 0 0 0
1 36 1 0 0 0 0
2 16 1 0 0 0 0
2 23 1 0 0 0 0
2 37 1 0 0 0 0
3 19 2 0 0 0 0
4 20 2 0 0 0 0
4 22 1 0 0 0 0
5 7 1 0 0 0 0
5 24 2 0 0 0 0
6 8 2 0 0 0 0
6 24 1 0 0 0 0
7 8 1 0 0 0 0
7 43 1 0 0 0 0
9 10 1 0 0 0 0
9 11 2 0 0 0 0
9 20 1 0 0 0 0
10 15 2 0 0 0 0
10 17 1 0 0 0 0
11 12 1 0 0 0 0
11 21 1 0 0 0 0
12 16 1 0 0 0 0
12 22 2 0 0 0 0
13 14 2 0 0 0 0
13 15 1 0 0 0 0
13 19 1 0 0 0 0
14 18 1 0 0 0 0
15 26 1 0 0 0 0
16 27 1 0 0 0 0
16 28 1 0 0 0 0
17 18 2 0 0 0 0
17 29 1 0 0 0 0
18 30 1 0 0 0 0
19 24 1 0 0 0 0
20 31 1 0 0 0 0
21 32 1 0 0 0 0
21 33 1 0 0 0 0
21 34 1 0 0 0 0
22 35 1 0 0 0 0
23 25 1 0 0 0 0
23 38 1 0 0 0 0
23 39 1 0 0 0 0
25 40 1 0 0 0 0
25 41 1 0 0 0 0
25 42 1 0 0 0 0
M END
$$$$