@<TRIPOS>MOLECULE
101609363
26 27 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1    -2.2510    -1.1035    -0.0606	S.3	1	noname	-0.0673
2	O1     0.6510     2.1189     0.0159	O.3	1	noname	-0.2107
3	O2     1.1264     1.4702     2.1196	O.2	1	noname	-0.2454
4	O3     1.6814    -1.2626    -2.2758	O.3	1	noname	-0.2728
5	N1     0.1371    -0.7393    -0.1439	N.2	1	noname	-0.2238
6	N2    -1.5518    -2.9940    -2.4111	N.2	1	noname	-0.2261
7	C1    -0.3273     0.0769     0.9094	C.3	1	noname	0.1537
8	C2    -1.8065     0.4974     0.7165	C.3	1	noname	0.0343
9	C3    -0.1782    -0.6693     2.2367	C.3	1	noname	-0.0291
10	C4    -0.7107    -1.4759    -0.7666	C.2	1	noname	0.0537
11	C5     0.5208     1.2573     1.0470	C.2	1	noname	0.1497
12	C6    -0.5227    -2.1972    -1.9294	C.2	1	noname	0.0528
13	C7     0.6184    -1.9523    -2.7415	C.2	1	noname	0.0526
14	C8     0.5884    -2.4698    -4.0732	C.2	1	noname	-0.0067
15	C9    -1.6104    -3.5192    -3.6811	C.2	1	noname	-0.0118
16	C10    -0.5184    -3.2198    -4.5493	C.2	1	noname	-0.0167
17	H1    -2.2917     0.5762     1.6893	H	1	noname	0.0415
18	H2    -1.9114     1.3347     0.0265	H	1	noname	0.0415
19	H3    -0.5370    -0.0388     3.0503	H	1	noname	0.0261
20	H4    -0.7631    -1.5885     2.2044	H	1	noname	0.0261
21	H5     0.8716    -0.9122     2.4011	H	1	noname	0.0261
22	H6     1.3787    -2.2966    -4.6943	H	1	noname	0.0651
23	H7     1.4825     2.6251    -0.0977	H	1	noname	0.2213
24	H8    -2.3955    -4.0941    -3.9870	H	1	noname	0.0839
25	H9    -0.5333    -3.5460    -5.5156	H	1	noname	0.0639
26	H10     2.3623    -1.1987    -2.9778	H	1	noname	0.2182
@<TRIPOS>BOND
1	1	8	1
2	1	10	1
3	2	11	1
4	2	23	1
5	3	11	2
6	4	13	1
7	4	26	1
8	5	7	1
9	5	10	2
10	6	12	1
11	6	15	2
12	7	8	1
13	7	9	1
14	7	11	1
15	8	17	1
16	8	18	1
17	9	19	1
18	9	20	1
19	9	21	1
20	10	12	1
21	12	13	2
22	13	14	1
23	14	16	2
24	14	22	1
25	15	16	1
26	15	24	1
27	16	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1