BP4LE1
-OEChem-04022119003D
35 37 0 0 0 0 0 0 0999 V2000
-4.2427 2.2510 0.1553 S 0 0 0 0 0 0 0 0 0 0 0 0
4.9536 2.1248 0.9993 F 0 0 0 0 0 0 0 0 0 0 0 0
4.9070 2.1668 -1.1741 F 0 0 0 0 0 0 0 0 0 0 0 0
3.4280 3.2749 -0.0389 F 0 0 0 0 0 0 0 0 0 0 0 0
-5.6188 1.7869 0.0491 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8489 3.0956 1.2742 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6623 -2.4685 0.0111 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.1509 -3.7166 0.0119 N 0 0 0 0 0 0 0 0 0 0 0 0
1.0773 -3.7620 -0.0486 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0824 -4.5034 -0.0251 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.8108 3.0334 -1.3010 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5020 -1.3613 0.0449 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6952 -2.5059 -0.0257 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5547 -1.3476 -0.0371 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1872 0.8609 0.1122 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7727 -1.4318 -0.5264 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0739 -0.1793 0.6495 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6153 -0.3209 -0.4926 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9165 0.9318 0.6833 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4830 -1.1581 0.9866 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4579 -0.4172 -1.0718 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2176 0.8922 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3144 -0.0383 0.9758 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2893 0.7028 -1.0828 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1064 2.0898 -0.0702 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1295 -2.3355 -1.0143 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1470 -0.0887 1.2021 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5974 -0.3955 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5693 1.8370 1.1735 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5699 -1.8732 1.8012 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7523 -0.5525 -1.8883 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0303 0.0910 1.7828 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2085 1.4208 -1.8945 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2811 3.9109 -1.2319 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4913 3.0181 -2.0704 H 0 0 0 0 0 0 0 0 0 0 0 0
1 5 2 0 0 0 0
1 6 2 0 0 0 0
1 11 1 0 0 0 0
1 15 1 0 0 0 0
2 25 1 0 0 0 0
3 25 1 0 0 0 0
4 25 1 0 0 0 0
7 8 1 0 0 0 0
7 12 1 0 0 0 0
7 13 1 0 0 0 0
8 10 2 0 0 0 0
9 10 1 0 0 0 0
9 13 2 0 0 0 0
11 34 1 0 0 0 0
11 35 1 0 0 0 0
12 16 2 0 0 0 0
12 17 1 0 0 0 0
13 14 1 0 0 0 0
14 20 2 0 0 0 0
14 21 1 0 0 0 0
15 18 2 0 0 0 0
15 19 1 0 0 0 0
16 18 1 0 0 0 0
16 26 1 0 0 0 0
17 19 2 0 0 0 0
17 27 1 0 0 0 0
18 28 1 0 0 0 0
19 29 1 0 0 0 0
20 23 1 0 0 0 0
20 30 1 0 0 0 0
21 24 2 0 0 0 0
21 31 1 0 0 0 0
22 23 2 0 0 0 0
22 24 1 0 0 0 0
22 25 1 0 0 0 0
23 32 1 0 0 0 0
24 33 1 0 0 0 0
M END
$$$$