@<TRIPOS>MOLECULE
118984379
485 494 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
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441	H188    -9.9234    -2.4655   -18.7399	H	1	noname	0.1319
442	H189   -37.0588   -11.8884    20.4499	H	1	noname	0.0432
443	H190   -35.9513   -13.1031    20.9876	H	1	noname	0.0432
444	H191   -23.3924   -15.3461    11.2683	H	1	noname	0.1271
445	H192   -24.8542   -15.5800    12.0560	H	1	noname	0.1271
446	H193    -8.4229    -0.4070   -16.4371	H	1	noname	0.0590
447	H194    -9.9048    -0.9198   -11.7217	H	1	noname	0.0410
448	H195    -8.8556    -1.9253   -10.6874	H	1	noname	0.0410
449	H196    -8.5452    -3.3601   -12.8883	H	1	noname	0.0568
450	H197   -21.6918   -21.0730    -0.2613	H	1	noname	0.0650
451	H198   -20.9713   -17.1599    -1.6166	H	1	noname	0.0650
452	H199   -44.6082   -12.9560    19.4079	H	1	noname	0.0625
453	H200   -44.8268   -15.9751    16.4285	H	1	noname	0.0625
454	H201    -7.2805    -2.6590   -14.9382	H	1	noname	0.1319
455	H202    -9.6467    -9.5410   -10.6620	H	1	noname	0.2101
456	H203   -31.5216   -20.9365     8.8074	H	1	noname	0.1271
457	H204   -30.1484   -20.8910     7.8490	H	1	noname	0.1271
458	H205    -6.2161    -0.5185   -17.5983	H	1	noname	0.0585
459	H206    -5.7468    -1.8152   -16.5266	H	1	noname	0.0585
460	H207   -38.1553   -12.2208    22.5778	H	1	noname	0.1306
461	H208   -46.8950   -12.3897    18.9697	H	1	noname	0.0622
462	H209   -47.1010   -15.3519    16.0023	H	1	noname	0.0622
463	H210   -36.1548   -18.5049    18.2538	H	1	noname	0.0625
464	H211   -32.2862   -16.7706    18.5250	H	1	noname	0.0625
465	H212   -40.1060   -16.4960    11.6376	H	1	noname	0.0808
466	H213   -24.8644   -27.5595     7.2211	H	1	noname	0.1267
467	H214   -26.1780   -26.7392     6.8885	H	1	noname	0.1267
468	H215   -48.1600   -13.5809    17.2769	H	1	noname	0.0622
469	H216    -7.1811    -0.9086   -12.0723	H	1	noname	0.1191
470	H217    -6.9757    -2.4370   -11.4344	H	1	noname	0.1191
471	H218   -31.0469   -20.8872    15.3309	H	1	noname	0.1271
472	H219   -29.4515   -20.7088    14.8454	H	1	noname	0.1271
473	H220   -23.0965   -26.7056     6.5550	H	1	noname	0.1898
474	H221   -36.6525   -17.6927    20.4484	H	1	noname	0.0622
475	H222   -32.8225   -15.9877    20.7249	H	1	noname	0.0622
476	H223   -39.3901   -18.1894     9.9311	H	1	noname	0.1531
477	H224   -11.3725    -0.8066   -18.8807	H	1	noname	0.1271
478	H225   -12.5919     0.2186   -18.3509	H	1	noname	0.1271
479	H226   -38.2027   -20.0863    11.0434	H	1	noname	0.1013
480	H227   -21.4625   -20.5955    -2.4138	H	1	noname	0.2181
481	H228   -34.9987   -16.4339    21.7019	H	1	noname	0.0622
482	H229    -4.9682     0.2520   -15.8117	H	1	noname	0.2101
483	H230   -36.2796   -10.5370    24.6990	H	1	noname	0.1267
484	H231   -37.7773   -10.9088    24.3416	H	1	noname	0.1267
485	H232   -35.0516   -10.1801    23.0940	H	1	noname	0.1898
@<TRIPOS>BOND
1	1	130	1
2	1	133	1
3	2	3	1
4	2	170	1
5	3	229	1
6	4	103	2
7	5	105	2
8	108	6	1
9	6	284	1
10	7	106	2
11	8	109	2
12	9	110	2
13	10	115	1
14	10	290	1
15	11	115	2
16	12	116	2
17	13	120	2
18	14	127	2
19	15	131	2
20	16	139	2
21	17	140	2
22	18	141	2
23	19	155	2
24	20	160	1
25	20	417	1
26	21	158	2
27	22	159	2
28	23	161	2
29	24	164	2
30	25	177	1
31	25	429	1
32	26	173	2
33	27	174	2
34	187	28	1
35	28	440	1
36	29	182	2
37	30	183	2
38	31	188	2
39	32	191	2
40	33	194	2
41	34	195	2
42	35	203	2
43	36	211	1
44	36	455	1
45	37	204	2
46	38	210	2
47	39	214	2
48	40	218	2
49	41	220	2
50	42	222	2
51	43	230	2
52	44	239	1
53	44	480	1
54	45	238	2
55	46	242	1
56	46	482	1
57	47	240	2
58	48	241	2
59	49	95	1
60	49	98	1
61	49	103	1
62	50	99	1
63	50	102	1
64	50	109	1
65	51	105	1
66	107	51	1
67	51	271	1
68	104	52	1
69	52	110	1
70	52	272	1
71	53	106	1
72	53	280	1
73	53	281	1
74	54	112	1
75	54	116	1
76	54	285	1
77	117	55	1
78	55	120	1
79	55	289	1
80	56	123	1
81	56	127	1
82	56	298	1
83	128	57	1
84	57	131	1
85	57	302	1
86	58	132	1
87	58	140	1
88	58	307	1
89	134	59	1
90	59	139	1
91	59	317	1
92	136	60	1
93	60	155	1
94	60	319	1
95	61	141	1
96	154	61	1
97	61	338	1
98	143	62	1
99	62	164	1
100	62	346	1
101	149	63	1
102	63	158	1
103	63	347	1
104	142	64	1
105	64	182	1
106	64	352	1
107	157	65	1
108	65	159	1
109	65	354	1
110	151	66	1
111	66	173	1
112	66	355	1
113	67	152	1
114	67	183	1
115	67	365	1
116	68	161	1
117	171	68	1
118	68	374	1
119	165	69	1
120	69	188	1
121	69	382	1
122	70	174	1
123	179	70	1
124	70	384	1
125	71	185	1
126	71	186	1
127	71	389	1
128	72	168	1
129	72	195	1
130	72	390	1
131	73	172	1
132	73	210	1
133	73	394	1
134	178	74	1
135	74	204	1
136	74	395	1
137	75	189	1
138	75	191	1
139	75	396	1
140	76	194	1
141	198	76	1
142	76	410	1
143	77	184	1
144	77	228	1
145	77	419	1
146	192	78	1
147	78	218	1
148	78	422	1
149	207	79	1
150	79	214	1
151	79	430	1
152	209	80	1
153	80	222	1
154	80	435	1
155	81	206	1
156	81	230	1
157	81	441	1
158	82	203	1
159	82	444	1
160	82	445	1
161	83	227	1
162	83	240	1
163	83	454	1
164	84	220	1
165	84	456	1
166	84	457	1
167	85	226	1
168	85	252	1
169	85	460	1
170	86	228	1
171	86	466	1
172	86	467	1
173	232	87	1
174	87	469	1
175	87	470	1
176	88	237	1
177	88	251	2
178	89	238	1
179	89	471	1
180	89	472	1
181	90	228	2
182	90	473	1
183	91	247	1
184	91	251	1
185	91	476	1
186	92	241	1
187	92	477	1
188	92	478	1
189	93	252	1
190	93	483	1
191	93	484	1
192	94	252	2
193	94	485	1
194	95	96	1
195	95	106	1
196	95	254	1
197	96	97	1
198	96	255	1
199	96	256	1
200	97	98	1
201	97	257	1
202	97	258	1
203	98	259	1
204	98	260	1
205	99	100	1
206	99	105	1
207	99	261	1
208	100	101	1
209	100	262	1
210	100	263	1
211	101	102	1
212	101	264	1
213	101	265	1
214	102	266	1
215	102	267	1
216	103	104	1
217	104	108	1
218	104	268	1
219	107	110	1
220	107	111	1
221	107	269	1
222	108	113	1
223	108	270	1
224	109	112	1
225	111	114	1
226	111	273	1
227	111	274	1
228	112	275	1
229	112	276	1
230	113	277	1
231	113	278	1
232	113	279	1
233	114	115	1
234	114	282	1
235	114	283	1
236	116	117	1
237	117	118	1
238	117	286	1
239	118	119	1
240	118	287	1
241	118	288	1
242	119	121	2
243	119	122	1
244	120	123	1
245	121	124	1
246	121	291	1
247	122	125	2
248	122	292	1
249	123	293	1
250	123	294	1
251	124	126	2
252	124	295	1
253	125	126	1
254	125	296	1
255	126	297	1
256	127	128	1
257	128	129	1
258	128	299	1
259	129	130	1
260	129	300	1
261	129	301	1
262	130	303	1
263	130	304	1
264	131	132	1
265	132	305	1
266	132	306	1
267	133	308	1
268	133	309	1
269	133	310	1
270	134	135	1
271	134	141	1
272	134	311	1
273	135	137	1
274	135	312	1
275	135	313	1
276	136	138	1
277	136	139	1
278	136	314	1
279	137	145	1
280	137	146	1
281	137	315	1
282	138	147	1
283	138	148	1
284	138	316	1
285	140	142	1
286	142	160	1
287	142	318	1
288	143	144	1
289	143	161	1
290	143	320	1
291	144	150	1
292	144	321	1
293	144	322	1
294	145	324	1
295	145	325	1
296	145	326	1
297	146	323	1
298	146	327	1
299	146	328	1
300	147	330	1
301	147	331	1
302	147	332	1
303	148	329	1
304	148	333	1
305	148	334	1
306	149	153	1
307	149	159	1
308	149	335	1
309	150	166	1
310	150	167	1
311	150	336	1
312	151	156	1
313	151	158	1
314	151	337	1
315	152	155	1
316	152	170	1
317	152	339	1
318	153	163	1
319	153	340	1
320	153	341	1
321	154	174	1
322	154	177	1
323	154	342	1
324	156	162	1
325	156	343	1
326	156	344	1
327	157	164	1
328	157	169	1
329	157	345	1
330	160	350	1
331	160	351	1
332	162	176	1
333	162	185	2
334	163	184	1
335	163	348	1
336	163	349	1
337	165	173	1
338	165	181	1
339	165	353	1
340	166	356	1
341	166	357	1
342	166	358	1
343	167	359	1
344	167	360	1
345	167	361	1
346	168	183	1
347	168	187	1
348	168	362	1
349	169	203	1
350	169	363	1
351	169	364	1
352	170	366	1
353	170	367	1
354	171	190	1
355	171	194	1
356	171	368	1
357	172	175	1
358	172	191	1
359	172	369	1
360	175	180	1
361	175	370	1
362	175	371	1
363	176	186	1
364	176	197	2
365	177	372	1
366	177	373	1
367	178	182	1
368	178	193	1
369	178	377	1
370	179	188	1
371	179	201	1
372	179	375	1
373	180	199	1
374	180	200	1
375	180	376	1
376	181	196	1
377	181	378	1
378	181	379	1
379	184	380	1
380	184	381	1
381	185	383	1
382	186	205	2
383	187	208	1
384	187	385	1
385	189	195	1
386	189	211	1
387	189	386	1
388	190	220	1
389	190	387	1
390	190	388	1
391	192	202	1
392	192	204	1
393	192	391	1
394	193	215	1
395	193	392	1
396	193	393	1
397	196	223	2
398	196	224	1
399	197	213	1
400	197	397	1
401	198	214	1
402	198	216	1
403	198	398	1
404	199	402	1
405	199	403	1
406	199	404	1
407	200	399	1
408	200	400	1
409	200	401	1
410	201	405	1
411	201	406	1
412	201	407	1
413	202	212	1
414	202	408	1
415	202	409	1
416	205	217	1
417	205	411	1
418	206	210	1
419	206	225	1
420	206	412	1
421	207	219	1
422	207	222	1
423	207	413	1
424	208	414	1
425	208	415	1
426	208	416	1
427	209	218	1
428	209	221	1
429	209	418	1
430	211	420	1
431	211	421	1
432	212	226	1
433	212	423	1
434	212	424	1
435	213	217	2
436	213	425	1
437	215	235	2
438	215	236	1
439	216	238	1
440	216	426	1
441	216	427	1
442	217	428	1
443	219	231	1
444	219	431	1
445	219	432	1
446	221	237	1
447	221	433	1
448	221	434	1
449	223	233	1
450	223	436	1
451	224	234	2
452	224	437	1
453	225	241	1
454	225	438	1
455	225	439	1
456	226	442	1
457	226	443	1
458	227	230	1
459	227	242	1
460	227	446	1
461	229	232	1
462	229	447	1
463	229	448	1
464	231	245	2
465	231	246	1
466	232	240	1
467	232	449	1
468	233	239	2
469	233	450	1
470	234	239	1
471	234	451	1
472	235	243	1
473	235	452	1
474	236	244	2
475	236	453	1
476	237	247	2
477	242	458	1
478	242	459	1
479	243	248	2
480	243	461	1
481	244	248	1
482	244	462	1
483	245	249	1
484	245	463	1
485	246	250	2
486	246	464	1
487	247	465	1
488	248	468	1
489	249	253	2
490	249	474	1
491	250	253	1
492	250	475	1
493	251	479	1
494	253	481	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
