@<TRIPOS>MOLECULE
DB01878
24 25 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.2501    -1.6050    -1.6270	O.2	1	noname	-0.2975
2	C1    -0.9095    -1.0107    -0.5814	C.2	1	noname	0.0597
3	C2     0.2145    -0.1930    -0.5814	C.2	1	noname	-0.0168
4	C3    -1.6548    -1.1677     0.5814	C.2	1	noname	-0.0168
5	C4     0.9598    -0.0361     0.5814	C.2	1	noname	-0.0194
6	C5     0.5932     0.4678    -1.7441	C.2	1	noname	-0.0194
7	C6    -2.7788    -1.9854     0.5814	C.2	1	noname	-0.0194
8	C7    -1.2761    -0.5069     1.7441	C.2	1	noname	-0.0194
9	C8     2.0838     0.7816     0.5814	C.2	1	noname	-0.0478
10	C9     1.7173     1.2855    -1.7441	C.2	1	noname	-0.0478
11	C10    -3.5241    -2.1423     1.7441	C.2	1	noname	-0.0478
12	C11    -2.0214    -0.6638     2.9069	C.2	1	noname	-0.0478
13	C12     2.4626     1.4424    -0.5814	C.2	1	noname	-0.0426
14	C13    -3.1454    -1.4815     2.9069	C.2	1	noname	-0.0426
15	H1     0.6628    -0.5543     1.4932	H	1	noname	0.0630
16	H2     0.0088     0.3447    -2.6559	H	1	noname	0.0630
17	H3    -3.0758    -2.5036    -0.3304	H	1	noname	0.0630
18	H4    -0.3947     0.1344     1.7441	H	1	noname	0.0630
19	H5     2.6683     0.9047     1.4932	H	1	noname	0.0622
20	H6     2.0142     1.8037    -2.6559	H	1	noname	0.0622
21	H7    -4.4056    -2.7835     1.7441	H	1	noname	0.0622
22	H8    -1.7244    -0.1456     3.8187	H	1	noname	0.0622
23	H9     3.3440     2.0837    -0.5814	H	1	noname	0.0622
24	H10    -3.7299    -1.6046     3.8187	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	3	5	2
5	3	6	1
6	4	7	2
7	4	8	1
8	5	9	1
9	6	10	2
10	7	11	1
11	8	12	2
12	9	13	2
13	10	13	1
14	11	14	2
15	12	14	1
16	5	15	1
17	6	16	1
18	7	17	1
19	8	18	1
20	9	19	1
21	10	20	1
22	11	21	1
23	12	22	1
24	13	23	1
25	14	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1