@<TRIPOS>MOLECULE
118984394
465 472 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
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436	H197     6.9976   -60.5562   -45.7134	H	1	noname	0.0257
437	H198     8.1307   -60.9681   -44.4039	H	1	noname	0.0257
438	H199     8.4693   -59.5847   -45.4715	H	1	noname	0.0257
439	H200   -11.6007   -52.2291   -49.2643	H	1	noname	0.2105
440	H201    -9.4111   -59.2394   -44.3701	H	1	noname	0.0257
441	H202   -10.5162   -58.6833   -45.6498	H	1	noname	0.0257
442	H203    -9.8011   -60.3109   -45.7369	H	1	noname	0.0257
443	H204     7.4136   -58.2432   -42.3626	H	1	noname	0.2105
444	H205    -7.2773   -54.3503   -43.4181	H	1	noname	0.0626
445	H206   -10.3482   -51.4224   -43.6069	H	1	noname	0.0626
446	H207    -4.6973   -49.5258   -54.2817	H	1	noname	0.1271
447	H208    -3.7326   -50.4998   -55.1896	H	1	noname	0.1271
448	H209     7.7973   -56.2312   -49.6279	H	1	noname	0.2101
449	H210    -0.5449   -51.9374   -53.8972	H	1	noname	0.0529
450	H211     1.0727   -52.8480   -53.8440	H	1	noname	0.0529
451	H212    -7.9063   -58.5824   -48.1427	H	1	noname	0.2105
452	H213    -3.4832   -57.6337   -48.0951	H	1	noname	0.0343
453	H214    -3.8234   -58.8822   -46.8729	H	1	noname	0.0343
454	H215    -2.2791   -58.9004   -47.7577	H	1	noname	0.0343
455	H216    -7.9239   -54.8568   -41.1748	H	1	noname	0.0650
456	H217   -10.9483   -51.9451   -41.3411	H	1	noname	0.0650
457	H218    -0.8589   -55.1810   -50.9284	H	1	noname	0.0568
458	H219     1.5329   -55.3715   -50.3522	H	1	noname	0.0410
459	H220     1.6599   -56.8433   -51.2848	H	1	noname	0.0410
460	H221    -1.4793   -53.7716   -52.7909	H	1	noname	0.1316
461	H222    -2.6548   -52.1062   -50.4914	H	1	noname	0.1271
462	H223    -1.1271   -51.4052   -50.3590	H	1	noname	0.1271
463	H224    -1.4191   -57.4244   -51.2472	H	1	noname	0.1191
464	H225    -1.8037   -56.5748   -52.6312	H	1	noname	0.1191
465	H226   -10.6038   -53.1789   -39.5242	H	1	noname	0.2181
@<TRIPOS>BOND
1	1	213	1
2	1	233	1
3	2	3	1
4	2	218	1
5	3	237	1
6	4	93	2
7	5	94	2
8	6	100	2
9	7	101	2
10	105	8	1
11	8	280	1
12	112	9	1
13	9	293	1
14	10	113	2
15	11	117	2
16	12	118	2
17	13	119	2
18	14	120	2
19	15	129	2
20	16	130	2
21	17	132	2
22	18	140	2
23	19	144	2
24	20	147	2
25	21	155	2
26	22	161	2
27	23	166	2
28	24	168	2
29	25	171	2
30	26	179	2
31	27	188	1
32	27	428	1
33	28	188	2
34	29	191	2
35	30	192	2
36	202	31	1
37	31	439	1
38	32	196	2
39	33	195	2
40	211	34	1
41	34	443	1
42	35	207	2
43	36	208	2
44	37	217	1
45	37	448	1
46	38	210	2
47	39	212	2
48	40	215	2
49	220	41	1
50	41	451	1
51	42	219	2
52	43	222	2
53	44	224	2
54	45	228	2
55	46	229	2
56	47	238	1
57	47	465	1
58	48	239	2
59	49	89	1
60	49	92	1
61	49	93	1
62	50	94	1
63	97	50	1
64	50	248	1
65	95	51	1
66	51	100	1
67	51	252	1
68	52	101	1
69	111	52	1
70	52	259	1
71	53	104	1
72	53	110	1
73	53	117	1
74	102	54	1
75	54	119	1
76	54	270	1
77	55	120	1
78	127	55	1
79	55	284	1
80	56	113	1
81	56	287	1
82	56	288	1
83	122	57	1
84	57	132	1
85	57	294	1
86	123	58	1
87	58	129	1
88	58	295	1
89	59	118	1
90	59	296	1
91	59	297	1
92	60	130	1
93	134	60	1
94	60	303	1
95	133	61	1
96	61	144	1
97	61	310	1
98	62	128	1
99	62	142	2
100	63	138	1
101	63	142	1
102	63	316	1
103	64	136	1
104	64	147	1
105	64	317	1
106	65	140	1
107	65	151	1
108	65	325	1
109	145	66	1
110	66	155	1
111	66	330	1
112	146	67	1
113	67	161	1
114	67	335	1
115	163	68	1
116	68	166	1
117	68	352	1
118	69	164	1
119	69	353	1
120	69	354	1
121	167	70	1
122	70	171	1
123	70	358	1
124	71	168	1
125	71	359	1
126	71	360	1
127	172	72	1
128	72	179	1
129	72	366	1
130	176	73	1
131	73	195	1
132	73	382	1
133	181	74	1
134	74	191	1
135	74	383	1
136	75	185	1
137	75	207	1
138	75	393	1
139	189	76	1
140	76	208	1
141	76	405	1
142	77	196	1
143	77	201	1
144	77	408	1
145	190	78	1
146	78	210	1
147	78	409	1
148	79	192	1
149	79	216	1
150	79	411	1
151	80	203	1
152	80	212	1
153	80	414	1
154	81	205	1
155	81	215	1
156	81	419	1
157	204	82	1
158	82	219	1
159	82	424	1
160	209	83	1
161	83	224	1
162	83	434	1
163	84	206	1
164	84	228	1
165	84	435	1
166	85	222	1
167	85	446	1
168	85	447	1
169	86	232	1
170	86	239	1
171	86	460	1
172	87	229	1
173	87	461	1
174	87	462	1
175	236	88	1
176	88	463	1
177	88	464	1
178	89	90	1
179	89	94	1
180	89	240	1
181	90	91	1
182	90	241	1
183	90	242	1
184	91	92	1
185	91	243	1
186	91	244	1
187	92	245	1
188	92	246	1
189	93	95	1
190	95	96	1
191	95	247	1
192	96	99	1
193	96	249	1
194	96	250	1
195	97	98	1
196	97	101	1
197	97	251	1
198	98	103	1
199	98	253	1
200	98	254	1
201	99	107	2
202	99	108	1
203	100	102	1
204	102	105	1
205	102	255	1
206	103	113	1
207	103	256	1
208	103	257	1
209	104	106	1
210	104	118	1
211	104	258	1
212	105	116	1
213	105	260	1
214	106	109	1
215	106	261	1
216	106	262	1
217	107	114	1
218	107	263	1
219	108	115	2
220	108	264	1
221	109	110	1
222	109	265	1
223	109	266	1
224	110	267	1
225	110	268	1
226	111	112	1
227	111	120	1
228	111	269	1
229	112	124	1
230	112	271	1
231	114	121	2
232	114	272	1
233	115	121	1
234	115	273	1
235	116	274	1
236	116	275	1
237	116	276	1
238	117	122	1
239	119	123	1
240	121	277	1
241	122	126	1
242	122	278	1
243	123	125	1
244	123	279	1
245	124	281	1
246	124	282	1
247	124	283	1
248	125	128	1
249	125	285	1
250	125	286	1
251	126	289	1
252	126	290	1
253	126	291	1
254	127	130	1
255	127	131	1
256	127	292	1
257	128	138	2
258	129	133	1
259	131	298	1
260	131	299	1
261	131	300	1
262	132	136	1
263	133	137	1
264	133	301	1
265	134	135	1
266	134	140	1
267	134	302	1
268	135	139	1
269	135	141	1
270	135	304	1
271	136	305	1
272	136	306	1
273	137	143	1
274	137	307	1
275	137	308	1
276	138	309	1
277	139	149	1
278	139	311	1
279	139	312	1
280	141	313	1
281	141	314	1
282	141	315	1
283	142	318	1
284	143	152	2
285	143	153	1
286	144	146	1
287	145	147	1
288	145	148	1
289	145	319	1
290	146	150	1
291	146	320	1
292	148	156	1
293	148	157	1
294	148	321	1
295	149	322	1
296	149	323	1
297	149	324	1
298	150	154	1
299	150	326	1
300	150	327	1
301	151	155	1
302	151	328	1
303	151	329	1
304	152	159	1
305	152	331	1
306	153	160	2
307	153	332	1
308	154	158	1
309	154	333	1
310	154	334	1
311	156	336	1
312	156	337	1
313	156	338	1
314	157	339	1
315	157	340	1
316	157	341	1
317	158	164	1
318	158	342	1
319	158	343	1
320	159	162	2
321	159	344	1
322	160	162	1
323	160	345	1
324	161	163	1
325	162	346	1
326	163	165	1
327	163	347	1
328	164	348	1
329	164	349	1
330	165	168	1
331	165	350	1
332	165	351	1
333	166	167	1
334	167	169	1
335	167	355	1
336	169	170	1
337	169	356	1
338	169	357	1
339	170	173	2
340	170	174	1
341	171	172	1
342	172	175	1
343	172	361	1
344	173	177	1
345	173	362	1
346	174	178	2
347	174	363	1
348	175	188	1
349	175	364	1
350	175	365	1
351	176	179	1
352	176	187	1
353	176	367	1
354	177	183	2
355	177	368	1
356	178	183	1
357	178	369	1
358	180	181	1
359	180	182	1
360	180	370	1
361	180	371	1
362	181	192	1
363	181	372	1
364	182	193	1
365	182	194	1
366	182	373	1
367	183	377	1
368	185	184	1
369	184	186	1
370	184	374	1
371	184	375	1
372	185	196	1
373	185	376	1
374	186	199	1
375	186	200	1
376	186	378	1
377	187	197	1
378	187	379	1
379	187	380	1
380	189	191	1
381	189	198	1
382	189	381	1
383	190	195	1
384	190	202	1
385	190	384	1
386	193	388	1
387	193	389	1
388	193	390	1
389	194	385	1
390	194	386	1
391	194	387	1
392	197	222	1
393	197	391	1
394	197	392	1
395	198	213	1
396	198	394	1
397	198	395	1
398	199	398	1
399	199	400	1
400	199	401	1
401	200	396	1
402	200	397	1
403	200	399	1
404	201	212	1
405	201	217	1
406	201	402	1
407	202	221	1
408	202	403	1
409	203	211	1
410	203	215	1
411	203	404	1
412	204	210	1
413	204	214	1
414	204	406	1
415	205	208	1
416	205	218	1
417	205	407	1
418	206	207	1
419	206	223	1
420	206	410	1
421	209	219	1
422	209	220	1
423	209	412	1
424	211	226	1
425	211	413	1
426	213	415	1
427	213	416	1
428	214	225	1
429	214	417	1
430	214	418	1
431	216	224	1
432	216	420	1
433	216	421	1
434	217	422	1
435	217	423	1
436	218	425	1
437	218	426	1
438	220	227	1
439	220	427	1
440	221	429	1
441	221	430	1
442	221	431	1
443	223	229	1
444	223	432	1
445	223	433	1
446	225	230	2
447	225	231	1
448	226	436	1
449	226	437	1
450	226	438	1
451	227	440	1
452	227	441	1
453	227	442	1
454	228	232	1
455	230	234	1
456	230	444	1
457	231	235	2
458	231	445	1
459	232	449	1
460	232	450	1
461	233	452	1
462	233	453	1
463	233	454	1
464	234	238	2
465	234	455	1
466	235	238	1
467	235	456	1
468	236	237	1
469	236	239	1
470	236	457	1
471	237	458	1
472	237	459	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
