@<TRIPOS>MOLECULE
118984443
434 435 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
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226	H12     5.4440    22.1887    36.1845	H	1	noname	0.0288
227	H13     5.6789    21.1516    37.3468	H	1	noname	0.0288
228	H14    10.4172    24.4188    41.3472	H	1	noname	0.0566
229	H15     6.1823    25.1318    39.5810	H	1	noname	0.0566
230	H16     9.7106    22.1793    39.3939	H	1	noname	0.0290
231	H17    10.3425    23.7859    38.9947	H	1	noname	0.0290
232	H18     3.4682    22.2556    39.5422	H	1	noname	0.1318
233	H19     1.9197    14.5743    36.2346	H	1	noname	0.0233
234	H20     1.4678    16.1346    35.5274	H	1	noname	0.0233
235	H21     2.9795    14.3983    38.4403	H	1	noname	0.0233
236	H22     3.5767    15.8016    39.2978	H	1	noname	0.0233
237	H23     4.3506    15.2510    37.8464	H	1	noname	0.0233
238	H24     3.1663    15.6270    35.5291	H	1	noname	0.0233
239	H25     3.8610    19.7847    36.0748	H	1	noname	0.0280
240	H26     4.1872    20.9038    34.7983	H	1	noname	0.0280
241	H27    11.8700    21.5861    40.5054	H	1	noname	0.0298
242	H28     9.3682    19.9811    41.9629	H	1	noname	0.0233
243	H29     8.6425    18.6605    41.2009	H	1	noname	0.0233
244	H30     8.8522    20.2177    40.3511	H	1	noname	0.0233
245	H31     7.9440    21.8054    42.9800	H	1	noname	0.0233
246	H32     6.2263    21.8186    42.7099	H	1	noname	0.0233
247	H33     7.2092    22.1421    41.4214	H	1	noname	0.0233
248	H34     5.6767    24.0065    37.1569	H	1	noname	0.0292
249	H35     6.5624    25.3757    37.4129	H	1	noname	0.0292
250	H36    -2.3311    17.0030    40.2662	H	1	noname	0.0566
251	H37     8.2261    16.8933    37.3972	H	1	noname	0.0566
252	H38     7.8379    22.7587    39.5050	H	1	noname	0.1318
253	H39    -0.1751    16.3873    39.2312	H	1	noname	0.0290
254	H40     0.0948    18.1373    38.9955	H	1	noname	0.0290
255	H41     6.3711    17.2072    39.4642	H	1	noname	0.1318
256	H42    -0.4911    17.0647    36.8658	H	1	noname	0.0298
257	H43     9.9901    21.6621    41.7698	H	1	noname	0.1318
258	H44    10.0730    21.7005    45.3080	H	1	noname	0.0566
259	H45     5.9461    19.5416    34.2312	H	1	noname	0.0432
260	H46     6.7791    20.1474    35.6391	H	1	noname	0.0432
261	H47     9.4899    16.8827    40.2055	H	1	noname	0.0292
262	H48     9.6845    18.2023    39.0609	H	1	noname	0.0292
263	H49    -4.3200    21.2353    39.7408	H	1	noname	0.0566
264	H50     8.1790    22.8034    37.6205	H	1	noname	0.0361
265	H51     8.6419    24.4268    37.1104	H	1	noname	0.0361
266	H52     0.5824    17.8125    43.8262	H	1	noname	0.0566
267	H53    13.8251    23.1178    40.2004	H	1	noname	0.0233
268	H54    13.1878    21.4534    38.3936	H	1	noname	0.0233
269	H55    11.4823    21.0651    38.0971	H	1	noname	0.0233
270	H56    12.1204    22.6594    37.6423	H	1	noname	0.0233
271	H57    12.5910    23.8940    41.1800	H	1	noname	0.0233
272	H58    12.7561    24.3406    39.4673	H	1	noname	0.0233
273	H59    -1.3828    19.7417    40.5304	H	1	noname	0.1318
274	H60    12.3342    22.7802    45.0108	H	1	noname	0.0288
275	H61    12.6529    21.6373    43.6994	H	1	noname	0.0288
276	H62    -2.3873    20.9231    42.0984	H	1	noname	0.0288
277	H63    -2.1193    21.9152    40.6446	H	1	noname	0.0288
278	H64     1.7958    15.7043    41.9518	H	1	noname	0.0288
279	H65     2.6452    16.0541    43.3793	H	1	noname	0.0288
280	H66     1.0418    17.8243    40.9210	H	1	noname	0.1318
281	H67    -2.8743    16.3561    36.5676	H	1	noname	0.0233
282	H68    -3.1826    16.5921    38.2760	H	1	noname	0.0233
283	H69    -2.0227    15.3493    37.7702	H	1	noname	0.0233
284	H70    -2.2129    18.7898    36.1606	H	1	noname	0.0233
285	H71    -2.4435    19.1678    37.8252	H	1	noname	0.0233
286	H72    -0.8407    19.5449    37.2348	H	1	noname	0.0233
287	H73   -10.5088    18.2500    39.1020	H	1	noname	0.0566
288	H74    12.4131    19.8210    45.5641	H	1	noname	0.0280
289	H75    12.5252    21.0777    46.7255	H	1	noname	0.0280
290	H76    10.6205    15.2581    38.3556	H	1	noname	0.0361
291	H77    10.8421    16.8101    37.5109	H	1	noname	0.0361
292	H78    -8.1793    18.2188    38.0303	H	1	noname	0.0290
293	H79    -8.1674    19.9907    38.1056	H	1	noname	0.0290
294	H80    -4.3192    22.4074    42.7239	H	1	noname	0.0280
295	H81    -3.9966    23.4175    41.2960	H	1	noname	0.0280
296	H82    -4.4917    19.2748    41.9338	H	1	noname	0.1318
297	H83    10.8924    19.9724    43.0794	H	1	noname	0.1318
298	H84     0.0230    14.7069    43.1809	H	1	noname	0.0280
299	H85     0.4320    15.5439    44.6997	H	1	noname	0.0280
300	H86   -10.0897    20.0790    36.5053	H	1	noname	0.0298
301	H87    -7.7466    19.6252    42.6251	H	1	noname	0.0590
302	H88     6.4915    18.2739    36.7647	H	1	noname	0.1306
303	H89     4.8623    19.0016    42.9545	H	1	noname	0.0566
304	H90     8.3093    15.3534    40.5979	H	1	noname	0.1316
305	H91    14.5455    20.6559    44.4259	H	1	noname	0.0432
306	H92    14.7601    21.7074    45.8505	H	1	noname	0.0432
307	H93    11.4098    11.3820    39.6800	H	1	noname	0.0566
308	H94     3.1151    17.6238    44.7211	H	1	noname	0.1318
309	H95    -1.9610    22.7679    43.5139	H	1	noname	0.0432
310	H96    -1.6570    23.8720    42.1425	H	1	noname	0.0432
311	H97    10.6678    11.8819    36.7621	H	1	noname	0.0290
312	H98    11.6721    10.5377    37.4000	H	1	noname	0.0290
313	H99    -7.2958    18.6868    39.8747	H	1	noname	0.1319
314	H100    -9.9347    21.0514    39.7142	H	1	noname	0.1318
315	H101     2.3247    13.6069    43.2540	H	1	noname	0.0432
316	H102     2.5978    14.3343    44.8675	H	1	noname	0.0432
317	H103     8.6836    10.9625    37.9087	H	1	noname	0.0298
318	H104     7.4163    12.7971    39.6383	H	1	noname	0.0529
319	H105     7.6000    13.3120    41.3194	H	1	noname	0.0529
320	H106    10.1736    17.0851    45.2882	H	1	noname	0.0563
321	H107   -12.9197    22.3597    38.9848	H	1	noname	0.0566
322	H108     5.1672    18.8393    45.9265	H	1	noname	0.0293
323	H109     6.4630    19.3008    44.8595	H	1	noname	0.0293
324	H110   -10.8500    17.9858    35.3591	H	1	noname	0.0233
325	H111   -11.2033    17.8936    37.0612	H	1	noname	0.0233
326	H112    -8.8392    19.2631    34.5039	H	1	noname	0.0233
327	H113    -7.7699    18.3076    35.5525	H	1	noname	0.0233
328	H114    -7.7472    20.0819    35.6366	H	1	noname	0.0233
329	H115    -9.7987    17.0186    36.4296	H	1	noname	0.0233
330	H116    -7.3062    17.1568    42.6279	H	1	noname	0.0585
331	H117    -5.8221    17.4184    41.6970	H	1	noname	0.0585
332	H118     9.7761    13.4749    38.4495	H	1	noname	0.1318
333	H119    14.6529    13.3924    37.2707	H	1	noname	0.0569
334	H120   -11.0786    22.0348    41.4211	H	1	noname	0.0293
335	H121   -10.7647    23.0609    40.0062	H	1	noname	0.0293
336	H122    12.8546    14.1044    34.9006	H	1	noname	0.0318
337	H123    11.7711    13.9287    37.0993	H	1	noname	0.1319
338	H124    14.3487    18.8147    46.1305	H	1	noname	0.1306
339	H125     4.1271    20.9090    45.7570	H	1	noname	0.0373
340	H126     4.3446    20.9869    44.0166	H	1	noname	0.0373
341	H127     8.8244     8.6784    38.9290	H	1	noname	0.0233
342	H128     9.8389     9.8023    39.8138	H	1	noname	0.0233
343	H129    10.5883     8.6687    38.6694	H	1	noname	0.0233
344	H130     8.4436     8.9592    36.4364	H	1	noname	0.0233
345	H131     9.2102    10.2961    35.5588	H	1	noname	0.0233
346	H132    10.1976     8.9452    36.1542	H	1	noname	0.0233
347	H133     9.6612    17.7941    42.5206	H	1	noname	0.1318
348	H134    -3.9218    24.3708    43.8963	H	1	noname	0.1306
349	H135    12.5046    17.7613    45.0864	H	1	noname	0.0251
350	H136    12.1744    16.4156    44.0612	H	1	noname	0.0251
351	H137    12.3052    18.0385    43.3333	H	1	noname	0.0251
352	H138     5.9918    23.7634    35.0598	H	1	noname	0.1271
353	H139     6.8582    22.9394    33.8911	H	1	noname	0.1271
354	H140   -13.1596    20.3539    41.1176	H	1	noname	0.1318
355	H141     0.2502    12.6938    44.3845	H	1	noname	0.1306
356	H142     7.3211    18.0219    43.3876	H	1	noname	0.1316
357	H143     7.1241    15.1784    42.8146	H	1	noname	0.0529
358	H144     7.6832    16.4726    41.7164	H	1	noname	0.0529
359	H145   -13.1000    23.4800    41.9432	H	1	noname	0.0373
360	H146   -12.6920    24.5029    40.5552	H	1	noname	0.0373
361	H147    11.8652    18.8247    38.9323	H	1	noname	0.1271
362	H148    13.2025    18.3532    39.8446	H	1	noname	0.1271
363	H149   -16.4058    20.8743    41.8666	H	1	noname	0.0590
364	H150    14.9082    13.6576    33.5443	H	1	noname	0.0234
365	H151    15.1865    15.0083    34.6439	H	1	noname	0.0234
366	H152    15.8478    13.4096    35.0405	H	1	noname	0.0234
367	H153    13.3598    11.7605    34.1782	H	1	noname	0.0234
368	H154    12.5663    11.7742    35.7072	H	1	noname	0.0234
369	H155    14.2872    11.4925    35.6877	H	1	noname	0.0234
370	H156     5.8974    15.1939    35.5468	H	1	noname	0.1267
371	H157     5.3948    16.1547    36.8838	H	1	noname	0.1267
372	H158    -5.4307    17.2555    43.9667	H	1	noname	0.2101
373	H159     5.4303    16.1073    33.7705	H	1	noname	0.1898
374	H160   -16.0788    19.9437    39.1240	H	1	noname	0.1319
375	H161   -16.0634    18.3899    41.9299	H	1	noname	0.0585
376	H162   -14.5967    18.5855    40.9826	H	1	noname	0.0585
377	H163   -19.3167    19.1826    38.4910	H	1	noname	0.0593
378	H164   -17.0266    20.9512    37.3989	H	1	noname	0.0619
379	H165    12.5379    16.1735    36.0794	H	1	noname	0.1271
380	H166    13.6315    17.3171    36.6408	H	1	noname	0.1271
381	H167   -18.8254    22.0367    38.9649	H	1	noname	0.1319
382	H168    15.7484    17.8037    47.1736	H	1	noname	0.1267
383	H169    16.9918    18.5677    47.7893	H	1	noname	0.1267
384	H170    -2.4366    26.9882    45.3548	H	1	noname	0.1267
385	H171    -3.6412    25.9794    45.5551	H	1	noname	0.1267
386	H172   -21.8967    23.1352    38.1456	H	1	noname	0.0569
387	H173     1.4780    10.1972    46.2347	H	1	noname	0.1267
388	H174     0.3502    11.2914    46.4349	H	1	noname	0.1267
389	H175    18.0261    19.9237    45.9752	H	1	noname	0.1898
390	H176    -0.6650    26.0004    45.1011	H	1	noname	0.1898
391	H177     6.1540    23.8631    44.8294	H	1	noname	0.2213
392	H178     3.3540    10.8487    45.7229	H	1	noname	0.1898
393	H179   -16.3600    18.5618    37.7479	H	1	noname	0.0257
394	H180   -17.7209    18.0621    36.7150	H	1	noname	0.0257
395	H181   -16.3957    19.0348    36.0323	H	1	noname	0.0257
396	H182   -20.9476    24.6656    39.9842	H	1	noname	0.0337
397	H183   -19.8330    23.4666    40.3754	H	1	noname	0.0337
398	H184   -14.1722    18.4710    43.2725	H	1	noname	0.2101
399	H185   -11.4163    26.2678    43.4638	H	1	noname	0.2213
400	H186   -22.3133    21.5528    40.4008	H	1	noname	0.1319
401	H187   -24.9615    22.2039    40.9694	H	1	noname	0.0593
402	H188   -19.2429    19.7623    36.0382	H	1	noname	0.2105
403	H189   -25.8614    23.4506    42.9041	H	1	noname	0.0619
404	H190   -22.6779    22.0163    42.6296	H	1	noname	0.1319
405	H191   -18.3114    25.4071    40.2210	H	1	noname	0.0625
406	H192   -20.0259    23.6932    36.7348	H	1	noname	0.0625
407	H193   -23.7510    24.3093    43.9093	H	1	noname	0.0257
408	H194   -25.0026    25.5554    43.6884	H	1	noname	0.0257
409	H195   -23.6243    25.4695    42.5654	H	1	noname	0.0257
410	H196   -16.5796    26.3682    38.8668	H	1	noname	0.0622
411	H197   -18.2784    24.6712    35.4185	H	1	noname	0.0622
412	H198   -26.4392    24.1277    40.8162	H	1	noname	0.2105
413	H199   -16.5464    26.0089    36.4671	H	1	noname	0.0622
414	H200   -22.9647    19.4636    43.7430	H	1	noname	0.0529
415	H201   -22.6667    20.8317    44.6486	H	1	noname	0.0529
416	H202   -25.1899    19.9641    45.4315	H	1	noname	0.1316
417	H203   -25.1748    19.2421    47.7593	H	1	noname	0.0571
418	H204   -24.7000    17.1199    49.1505	H	1	noname	0.0394
419	H205   -23.3952    16.7767    48.1445	H	1	noname	0.0394
420	H206   -25.5907    17.2128    45.8753	H	1	noname	0.1319
421	H207   -28.2376    16.9260    45.8722	H	1	noname	0.0590
422	H208   -29.8214    15.3695    46.8507	H	1	noname	0.0585
423	H209   -29.5372    16.7179    47.9567	H	1	noname	0.0585
424	H210   -26.3376    14.9035    46.3887	H	1	noname	0.1319
425	H211   -26.1373    13.5574    43.9946	H	1	noname	0.0563
426	H212   -28.5865    11.7435    44.3325	H	1	noname	0.0353
427	H213   -28.2559    12.7479    42.9187	H	1	noname	0.0353
428	H214   -21.7395    18.3477    50.8948	H	1	noname	0.2213
429	H215   -29.5287    14.6679    49.0422	H	1	noname	0.2101
430	H216   -27.1931    12.1156    46.3270	H	1	noname	0.1191
431	H217   -25.8904    11.6369    45.4002	H	1	noname	0.1191
432	H218   -27.4357    11.4241    40.9557	H	1	noname	0.0808
433	H219   -25.9965     9.3946    40.6503	H	1	noname	0.1531
434	H220   -25.2136     8.5521    42.8659	H	1	noname	0.1013
@<TRIPOS>BOND
1	1	92	2
2	2	94	2
3	3	98	2
4	4	103	2
5	5	108	2
6	6	117	2
7	7	122	2
8	8	124	2
9	9	126	2
10	10	136	2
11	11	138	2
12	12	140	2
13	13	141	2
14	14	146	2
15	15	155	1
16	15	372	1
17	16	156	2
18	17	157	2
19	18	158	2
20	19	159	2
21	20	163	2
22	21	171	2
23	22	172	2
24	23	176	2
25	24	179	1
26	24	391	1
27	25	179	2
28	26	181	1
29	26	398	1
30	27	183	1
31	27	399	1
32	28	183	2
33	185	29	1
34	29	402	1
35	30	184	2
36	31	187	2
37	32	192	2
38	193	33	1
39	33	412	1
40	34	199	2
41	35	203	2
42	36	205	2
43	37	207	1
44	37	428	1
45	38	207	2
46	39	208	1
47	39	429	1
48	40	209	2
49	85	41	1
50	41	94	1
51	41	224	1
52	87	42	1
53	42	92	1
54	42	225	1
55	90	43	1
56	43	103	1
57	43	232	1
58	96	44	1
59	44	108	1
60	44	252	1
61	45	98	1
62	109	45	1
63	45	255	1
64	95	46	1
65	46	117	1
66	46	257	1
67	107	47	1
68	47	124	1
69	47	273	1
70	118	48	1
71	48	122	1
72	48	280	1
73	115	49	1
74	49	138	1
75	49	296	1
76	112	50	1
77	50	146	1
78	50	297	1
79	51	113	1
80	51	160	1
81	51	302	1
82	52	126	1
83	52	149	1
84	52	304	1
85	53	136	1
86	139	53	1
87	53	308	1
88	137	54	1
89	54	141	1
90	54	313	1
91	130	55	1
92	55	157	1
93	55	314	1
94	143	56	1
95	56	159	1
96	56	332	1
97	57	158	1
98	161	57	1
99	57	337	1
100	58	142	1
101	58	177	1
102	58	338	1
103	150	59	1
104	59	171	1
105	59	347	1
106	60	144	1
107	60	178	1
108	60	348	1
109	61	140	1
110	61	352	1
111	61	353	1
112	151	62	1
113	62	172	1
114	62	354	1
115	63	147	1
116	63	180	1
117	63	355	1
118	64	163	1
119	64	169	1
120	64	356	1
121	65	156	1
122	65	361	1
123	65	362	1
124	66	160	1
125	66	370	1
126	66	371	1
127	67	160	2
128	67	373	1
129	173	68	1
130	68	184	1
131	68	374	1
132	69	176	1
133	69	379	1
134	69	380	1
135	182	70	1
136	70	187	1
137	70	381	1
138	71	177	1
139	71	382	1
140	71	383	1
141	72	178	1
142	72	384	1
143	72	385	1
144	73	180	1
145	73	387	1
146	73	388	1
147	74	177	2
148	74	389	1
149	75	178	2
150	75	390	1
151	76	180	2
152	76	392	1
153	186	77	1
154	77	192	1
155	77	400	1
156	190	78	1
157	78	199	1
158	78	404	1
159	79	201	1
160	79	203	1
161	79	416	1
162	202	80	1
163	80	205	1
164	80	420	1
165	206	81	1
166	81	209	1
167	81	424	1
168	210	82	1
169	82	430	1
170	82	431	1
171	83	212	1
172	83	214	2
173	84	213	1
174	84	214	1
175	84	433	1
176	85	86	1
177	85	92	1
178	85	215	1
179	86	88	1
180	86	216	1
181	86	217	1
182	87	89	1
183	87	98	1
184	87	218	1
185	88	99	1
186	88	100	1
187	88	219	1
188	89	91	1
189	89	220	1
190	89	221	1
191	90	93	1
192	90	94	1
193	90	222	1
194	91	104	1
195	91	105	1
196	91	223	1
197	93	101	1
198	93	226	1
199	93	227	1
200	95	97	1
201	95	108	1
202	95	228	1
203	96	103	1
204	96	106	1
205	96	229	1
206	97	102	1
207	97	230	1
208	97	231	1
209	99	233	1
210	99	234	1
211	99	238	1
212	100	235	1
213	100	236	1
214	100	237	1
215	101	113	1
216	101	239	1
217	101	240	1
218	102	119	1
219	102	120	1
220	102	241	1
221	104	242	1
222	104	243	1
223	104	244	1
224	105	245	1
225	105	246	1
226	105	247	1
227	106	116	1
228	106	248	1
229	106	249	1
230	107	110	1
231	107	122	1
232	107	250	1
233	109	114	1
234	109	126	1
235	109	251	1
236	110	111	1
237	110	253	1
238	110	254	1
239	111	127	1
240	111	128	1
241	111	256	1
242	112	117	1
243	112	121	1
244	112	258	1
245	113	259	1
246	113	260	1
247	114	131	1
248	114	261	1
249	114	262	1
250	115	123	1
251	115	124	1
252	115	263	1
253	116	140	1
254	116	264	1
255	116	265	1
256	118	125	1
257	118	136	1
258	118	266	1
259	119	268	1
260	119	269	1
261	119	270	1
262	120	267	1
263	120	271	1
264	120	272	1
265	121	129	1
266	121	274	1
267	121	275	1
268	123	133	1
269	123	276	1
270	123	277	1
271	125	134	1
272	125	278	1
273	125	279	1
274	127	281	1
275	127	282	1
276	127	283	1
277	128	284	1
278	128	285	1
279	128	286	1
280	129	142	1
281	129	288	1
282	129	289	1
283	130	132	1
284	130	141	1
285	130	287	1
286	131	156	1
287	131	290	1
288	131	291	1
289	132	135	1
290	132	292	1
291	132	293	1
292	133	144	1
293	133	294	1
294	133	295	1
295	134	147	1
296	134	298	1
297	134	299	1
298	135	153	1
299	135	154	1
300	135	300	1
301	137	138	1
302	137	155	1
303	137	301	1
304	139	152	1
305	139	163	1
306	139	303	1
307	142	305	1
308	142	306	1
309	143	145	1
310	143	158	1
311	143	307	1
312	144	309	1
313	144	310	1
314	145	148	1
315	145	311	1
316	145	312	1
317	146	150	1
318	147	315	1
319	147	316	1
320	148	166	1
321	148	167	1
322	148	317	1
323	149	159	1
324	149	318	1
325	149	319	1
326	150	168	1
327	150	320	1
328	151	157	1
329	151	162	1
330	151	321	1
331	152	165	1
332	152	322	1
333	152	323	1
334	153	326	1
335	153	327	1
336	153	328	1
337	154	324	1
338	154	325	1
339	154	329	1
340	155	330	1
341	155	331	1
342	161	164	1
343	161	176	1
344	161	333	1
345	162	170	1
346	162	334	1
347	162	335	1
348	164	174	1
349	164	175	1
350	164	336	1
351	165	179	1
352	165	339	1
353	165	340	1
354	166	344	1
355	166	345	1
356	166	346	1
357	167	341	1
358	167	342	1
359	167	343	1
360	168	349	1
361	168	350	1
362	168	351	1
363	169	171	1
364	169	357	1
365	169	358	1
366	170	183	1
367	170	359	1
368	170	360	1
369	172	173	1
370	173	181	1
371	173	363	1
372	174	367	1
373	174	368	1
374	174	369	1
375	175	364	1
376	175	365	1
377	175	366	1
378	181	375	1
379	181	376	1
380	182	184	1
381	182	185	1
382	182	377	1
383	185	188	1
384	185	378	1
385	186	187	1
386	186	189	1
387	186	386	1
388	188	393	1
389	188	394	1
390	188	395	1
391	189	191	1
392	189	396	1
393	189	397	1
394	190	192	1
395	190	193	1
396	190	401	1
397	191	194	2
398	191	195	1
399	193	196	1
400	193	403	1
401	194	197	1
402	194	405	1
403	195	198	2
404	195	406	1
405	196	407	1
406	196	408	1
407	196	409	1
408	197	200	2
409	197	410	1
410	198	200	1
411	198	411	1
412	199	201	1
413	200	413	1
414	201	414	1
415	201	415	1
416	202	203	1
417	202	204	1
418	202	417	1
419	204	207	1
420	204	418	1
421	204	419	1
422	205	206	1
423	206	208	1
424	206	421	1
425	208	422	1
426	208	423	1
427	209	210	1
428	210	211	1
429	210	425	1
430	211	212	1
431	211	426	1
432	211	427	1
433	212	213	2
434	213	432	1
435	214	434	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
