B2T8CF
-OEChem-04022103033D
58 61 0 1 0 0 0 0 0999 V2000
1.2110 -3.1156 0.9162 N 0 0 0 0 0 0 0 0 0 0 0 0
1.7993 1.7850 -0.3487 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5026 -2.1265 -1.4527 N 0 0 2 0 0 0 0 0 0 0 0 0
0.2423 3.9752 -1.3121 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.9838 -1.1758 0.7872 N 0 0 0 0 0 0 0 0 0 0 0 0
0.6046 -2.4224 -0.2262 C 0 0 2 0 0 0 0 0 0 0 0 0
0.8026 -0.9059 -0.0714 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2255 -0.5369 0.2665 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1059 -1.5061 0.7786 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6588 0.7879 0.1259 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8820 -2.7650 -0.3025 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6679 -2.9432 0.9134 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5165 2.9294 0.5282 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7204 2.0526 -1.7888 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2200 3.6194 0.1058 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4171 2.7754 -2.1288 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4184 -1.1415 1.1073 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9641 1.1420 0.4663 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8437 0.1781 0.9541 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9485 -1.9945 -1.2557 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2272 -2.8824 -2.6773 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2863 -0.8588 -0.3266 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8786 0.4260 -0.6471 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2077 1.4517 0.2322 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2855 -0.1528 1.6181 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9245 1.1651 1.3888 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2914 2.2397 2.3493 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1116 -2.7679 -1.1364 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1574 -0.5161 0.7273 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5084 -0.4221 -1.0088 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3460 -2.4289 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0309 -3.8537 -0.3293 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1084 -3.5244 0.0938 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0533 -3.3508 1.8549 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9939 -4.1111 0.8758 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3485 3.6438 0.4872 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4130 2.5974 1.5687 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7678 1.1182 -2.3607 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5809 2.6629 -2.0915 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6337 2.9673 0.3169 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0845 4.5283 0.7018 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4355 2.1010 -1.9898 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4300 3.0610 -3.1863 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1163 -1.8850 1.4842 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3172 2.1637 0.3519 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6391 4.4242 -1.5594 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8618 0.4533 1.2135 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3911 -2.9341 -0.8985 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4467 -1.7661 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1548 -2.9431 -2.8855 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6705 -2.3778 -3.5437 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6303 -3.9009 -2.6345 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3306 0.6423 -1.5573 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9160 2.4715 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8468 -0.4393 2.5022 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2498 2.6865 2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3748 1.8480 3.3687 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5293 3.0263 2.3691 H 0 0 0 0 0 0 0 0 0 0 0 0
1 6 1 0 0 0 0
1 12 1 0 0 0 0
1 35 1 0 0 0 0
2 10 1 0 0 0 0
2 13 1 0 0 0 0
2 14 1 0 0 0 0
3 11 1 0 0 0 0
3 20 1 0 0 0 0
3 21 1 0 0 0 0
4 15 1 0 0 0 0
4 16 1 0 0 0 0
4 46 1 0 0 0 0
5 22 2 0 0 0 0
5 25 1 0 0 0 0
6 7 1 0 0 0 0
6 11 1 0 0 0 0
6 28 1 0 0 0 0
7 8 1 0 0 0 0
7 29 1 0 0 0 0
7 30 1 0 0 0 0
8 9 2 0 0 0 0
8 10 1 0 0 0 0
9 12 1 0 0 0 0
9 17 1 0 0 0 0
10 18 2 0 0 0 0
11 31 1 0 0 0 0
11 32 1 0 0 0 0
12 33 1 0 0 0 0
12 34 1 0 0 0 0
13 15 1 0 0 0 0
13 36 1 0 0 0 0
13 37 1 0 0 0 0
14 16 1 0 0 0 0
14 38 1 0 0 0 0
14 39 1 0 0 0 0
15 40 1 0 0 0 0
15 41 1 0 0 0 0
16 42 1 0 0 0 0
16 43 1 0 0 0 0
17 19 2 0 0 0 0
17 44 1 0 0 0 0
18 19 1 0 0 0 0
18 45 1 0 0 0 0
19 47 1 0 0 0 0
20 22 1 0 0 0 0
20 48 1 0 0 0 0
20 49 1 0 0 0 0
21 50 1 0 0 0 0
21 51 1 0 0 0 0
21 52 1 0 0 0 0
22 23 1 0 0 0 0
23 24 2 0 0 0 0
23 53 1 0 0 0 0
24 26 1 0 0 0 0
24 54 1 0 0 0 0
25 26 2 0 0 0 0
25 55 1 0 0 0 0
26 27 1 0 0 0 0
27 56 1 0 0 0 0
27 57 1 0 0 0 0
27 58 1 0 0 0 0
M END
$$$$