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LAMMPS data file. CGCMM style. atom_style full generated by VMD/TopoTools v1.4 on Tue Aug 05 00:31:12 EDT 2014
12
-0.160700 12.263700 xlo xhi
13
0.088670 12.513070 ylo yhi
14
-0.104992 12.319408 zlo zhi
23
1 1 1 -1.112800 8.865130 6.503010 11.121500 # O
24
2 1 2 0.556400 8.520580 6.510690 12.010700 # H
25
3 1 2 0.556400 9.732920 6.095080 11.252600 # H
26
4 2 1 -1.112800 9.057870 9.808280 0.453392 # O
27
5 2 2 0.556400 8.226490 9.807820 -0.069800 # H
28
6 2 2 0.556400 9.803510 9.663050 -0.208053 # H
29
7 3 1 -1.112800 4.233750 5.283420 5.673040 # O
30
8 3 2 0.556400 3.609940 4.927770 5.028710 # H
31
9 3 2 0.556400 4.506350 6.135170 5.403380 # H
32
10 4 1 -1.112800 6.210960 12.255200 3.667540 # O
33
11 4 2 0.556400 6.203190 12.988556 4.301280 # H
34
12 4 2 0.556400 5.315370 12.213238 3.274570 # H
35
13 5 1 -1.112800 6.275240 1.053570 6.253780 # O
36
14 5 2 0.556400 5.974360 0.104128 6.328520 # H
37
15 5 2 0.556400 7.171460 1.060860 6.668600 # H
38
16 6 1 -1.112800 1.413870 8.608640 3.047230 # O
39
17 6 2 0.556400 1.361670 9.551560 3.309720 # H
40
18 6 2 0.556400 1.889760 8.168230 3.715680 # H
41
19 7 1 -1.112800 5.657890 7.278710 0.675859 # O
42
20 7 2 0.556400 5.220170 6.635890 0.022046 # H
43
21 7 2 0.556400 4.956600 7.815440 1.121120 # H
44
22 8 1 -1.112800 4.540490 5.624290 11.350300 # O
45
23 8 2 0.556400 4.956510 4.796040 11.676400 # H
46
24 8 2 0.556400 4.750030 5.536620 10.412400 # H
47
25 9 1 -1.112800 0.035729 6.794620 1.097950 # O
48
26 9 2 0.556400 0.764984 6.256710 0.729692 # H
49
27 9 2 0.556400 0.398995 7.264730 1.849450 # H
50
28 10 1 -1.112800 3.738790 11.789600 2.452560 # O
51
29 10 2 0.556400 3.256890 11.850800 3.289280 # H
52
30 10 2 0.556400 3.064120 12.136500 1.778280 # H
53
31 11 1 -1.112800 0.733014 8.956180 7.270280 # O
54
32 11 2 0.556400 0.723334 8.457920 8.118450 # H
55
33 11 2 0.556400 1.129240 8.333990 6.703650 # H
56
34 12 1 -1.112800 11.229600 5.419700 10.216400 # O
57
35 12 2 0.556400 11.257700 5.103210 9.245840 # H
58
36 12 2 0.556400 11.472200 4.626020 10.675700 # H
59
37 13 1 -1.112800 1.539670 4.958490 7.189480 # O
60
38 13 2 0.556400 1.878900 4.355830 7.898400 # H
61
39 13 2 0.556400 0.608435 4.871290 7.333760 # H
62
40 14 1 -1.112800 5.194700 12.585900 11.877400 # O
63
41 14 2 0.556400 4.461940 12.002400 11.789800 # H
64
42 14 2 0.556400 5.800990 12.245600 12.546000 # H
65
43 15 1 -1.112800 10.541200 2.760930 3.671840 # O
66
44 15 2 0.556400 11.379900 3.110720 3.527720 # H
67
45 15 2 0.556400 10.563000 2.456660 4.545780 # H
68
46 16 1 -1.112800 1.735430 7.179310 5.391120 # O
69
47 16 2 0.556400 1.912490 6.544840 6.054940 # H
70
48 16 2 0.556400 0.898627 6.824870 5.088220 # H
71
49 17 1 -1.112800 6.877010 9.701870 4.336910 # O
72
50 17 2 0.556400 7.706420 9.450460 3.962120 # H
73
51 17 2 0.556400 6.830650 10.663800 4.252280 # H
74
52 18 1 -1.112800 8.923860 10.150500 7.400990 # O
75
53 18 2 0.556400 9.602800 9.557930 7.035830 # H
76
54 18 2 0.556400 8.369470 9.565990 7.937380 # H
77
55 19 1 -1.112800 10.783800 1.901810 6.155600 # O
78
56 19 2 0.556400 10.112100 1.498190 6.720110 # H
79
57 19 2 0.556400 11.535100 1.720670 6.693580 # H
80
58 20 1 -1.112800 5.227830 4.006860 2.302480 # O
81
59 20 2 0.556400 6.032370 4.085210 2.819820 # H
82
60 20 2 0.556400 5.290180 3.534110 1.481430 # H
83
61 21 1 -1.112800 5.125500 6.303080 8.382970 # O
84
62 21 2 0.556400 5.806420 5.617560 8.363370 # H
85
63 21 2 0.556400 4.490420 6.026330 7.778310 # H
86
64 22 1 -1.112800 0.456225 1.612050 8.056750 # O
87
65 22 2 0.556400 -0.025900 1.631960 8.898430 # H
88
66 22 2 0.556400 0.669755 0.625552 7.930950 # H
89
67 23 1 -1.112800 8.782040 3.471990 0.076822 # O
90
68 23 2 0.556400 8.202080 3.783770 0.746958 # H
91
69 23 2 0.556400 8.289680 3.164470 -0.665500 # H
92
70 24 1 -1.112800 1.672550 11.525400 7.292890 # O
93
71 24 2 0.556400 2.516940 11.757200 7.647260 # H
94
72 24 2 0.556400 1.487570 10.628700 7.531310 # H
95
73 25 1 -1.112800 1.364380 1.590440 3.663260 # O
96
74 25 2 0.556400 1.547320 1.223950 2.810090 # H
97
75 25 2 0.556400 1.074800 0.873519 4.174980 # H
98
76 26 1 -1.112800 8.689780 0.747241 7.379040 # O
99
77 26 2 0.556400 8.349180 0.921581 8.253930 # H
100
78 26 2 0.556400 9.036230 -0.154800 7.321810 # H
101
79 27 1 -1.112800 4.073020 8.755140 6.871380 # O
102
80 27 2 0.556400 4.306480 9.677620 6.980050 # H
103
81 27 2 0.556400 3.814440 8.535430 7.766820 # H
104
82 28 1 -1.112800 0.498442 3.851310 2.444790 # O
105
83 28 2 0.556400 0.654284 3.038590 2.870310 # H
106
84 28 2 0.556400 1.085810 4.484760 2.771370 # H
107
85 29 1 -1.112800 1.632160 11.104300 4.639990 # O
108
86 29 2 0.556400 1.743950 11.223400 5.572490 # H
109
87 29 2 0.556400 0.716740 10.800100 4.534040 # H
110
88 30 1 -1.112800 11.501400 1.217000 10.514400 # O
111
89 30 2 0.556400 10.582200 0.941987 10.575700 # H
112
90 30 2 0.556400 11.606600 1.981940 11.138600 # H
113
91 31 1 -1.112800 7.555960 0.146718 1.260860 # O
114
92 31 2 0.556400 7.949870 -0.667300 1.043520 # H
115
93 31 2 0.556400 7.138220 -0.047500 2.115990 # H
116
94 32 1 -1.112800 6.878570 7.721550 6.541450 # O
117
95 32 2 0.556400 7.135770 8.376320 5.940780 # H
118
96 32 2 0.556400 5.970910 7.920750 6.721600 # H
119
97 33 1 -1.112800 7.982210 5.292580 6.003760 # O
120
98 33 2 0.556400 8.909520 5.411240 5.926560 # H
121
99 33 2 0.556400 7.652470 6.207230 6.044110 # H
122
100 34 1 -1.112800 5.616110 10.935500 6.811260 # O
123
101 34 2 0.556400 6.363500 10.479300 6.482600 # H
124
102 34 2 0.556400 5.919440 11.184400 7.657440 # H
125
103 35 1 -1.112800 1.790630 0.357214 1.054180 # O
126
104 35 2 0.556400 1.057720 -0.216500 0.738618 # H
127
105 35 2 0.556400 1.953810 1.002820 0.368886 # H
128
106 36 1 -1.112800 10.283000 6.567040 2.571750 # O
129
107 36 2 0.556400 9.663420 6.322490 1.952700 # H
130
108 36 2 0.556400 11.030100 6.486050 1.980270 # H
131
109 37 1 -1.112800 2.290660 2.508490 11.784300 # O
132
110 37 2 0.556400 2.307070 2.658020 10.827900 # H
133
111 37 2 0.556400 2.081570 3.326220 12.203200 # H
134
112 38 1 -1.112800 7.227130 2.546230 10.396400 # O
135
113 38 2 0.556400 6.387210 2.711920 10.860900 # H
136
114 38 2 0.556400 7.452090 3.339380 9.859950 # H
137
115 39 1 -1.112800 10.713300 8.703520 6.190950 # O
138
116 39 2 0.556400 10.819800 9.249690 5.391950 # H
139
117 39 2 0.556400 11.524100 8.799950 6.668930 # H
140
118 40 1 -1.112800 12.000900 11.351800 0.188623 # O
141
119 40 2 0.556400 11.848900 11.826300 -0.697100 # H
142
120 40 2 0.556400 11.560000 11.967800 0.744819 # H
143
121 41 1 -1.112800 7.613350 4.878920 8.986350 # O
144
122 41 2 0.556400 7.858040 5.206450 8.126690 # H
145
123 41 2 0.556400 8.153130 5.431090 9.580010 # H
146
124 42 1 -1.112800 9.399660 9.104240 3.193160 # O
147
125 42 2 0.556400 9.192160 9.329720 2.265890 # H
148
126 42 2 0.556400 9.746630 8.194570 3.038160 # H
149
127 43 1 -1.112800 6.110810 12.293200 9.256280 # O
150
128 43 2 0.556400 5.674220 12.030500 10.043000 # H
151
129 43 2 0.556400 6.211290 13.269039 9.193900 # H
152
130 44 1 -1.112800 8.977380 0.134346 10.851900 # O
153
131 44 2 0.556400 8.406550 -0.509500 10.478500 # H
154
132 44 2 0.556400 8.472070 0.738628 11.418100 # H
155
133 45 1 -1.112800 10.737500 6.125960 5.402620 # O
156
134 45 2 0.556400 10.814800 7.033850 5.668770 # H
157
135 45 2 0.556400 10.473200 5.989030 4.507260 # H
158
136 46 1 -1.112800 2.828860 5.338020 3.155120 # O
159
137 46 2 0.556400 3.115240 6.111620 3.566130 # H
160
138 46 2 0.556400 3.652960 4.901350 2.802110 # H
161
139 47 1 -1.112800 11.623100 8.822650 11.443800 # O
162
140 47 2 0.556400 11.819000 8.028750 11.942900 # H
163
141 47 2 0.556400 11.846900 9.639150 11.910200 # H
164
142 48 1 -1.112800 2.196920 5.192020 0.491763 # O
165
143 48 2 0.556400 2.397930 5.229040 1.410490 # H
166
144 48 2 0.556400 2.944260 5.694820 0.162800 # H
167
145 49 1 -1.112800 3.293400 9.113640 1.147790 # O
168
146 49 2 0.556400 3.487550 9.977400 1.432320 # H
169
147 49 2 0.556400 2.748220 8.848930 1.907350 # H
170
148 50 1 -1.112800 11.088800 11.001400 4.049660 # O
171
149 50 2 0.556400 10.878300 11.717500 3.452910 # H
172
150 50 2 0.556400 10.463700 10.416800 3.674780 # H
173
151 51 1 -1.112800 3.297820 10.609800 11.272100 # O
174
152 51 2 0.556400 2.695600 10.181300 11.864000 # H
175
153 51 2 0.556400 3.766060 9.889320 10.814000 # H
176
154 52 1 -1.112800 5.136170 2.839760 12.047300 # O
177
155 52 2 0.556400 4.182540 2.709670 11.986300 # H
178
156 52 2 0.556400 5.277560 1.871320 12.145200 # H
179
157 53 1 -1.112800 6.666230 9.750290 11.852900 # O
180
158 53 2 0.556400 6.315340 8.898120 12.198600 # H
181
159 53 2 0.556400 6.880880 9.588630 10.927400 # H
182
160 54 1 -1.112800 7.880750 4.211900 3.434410 # O
183
161 54 2 0.556400 7.759280 4.346270 4.378860 # H
184
162 54 2 0.556400 8.768200 3.904830 3.353740 # H
185
163 55 1 -1.112800 7.546130 8.662960 9.307760 # O
186
164 55 2 0.556400 7.028650 8.213840 8.622330 # H
187
165 55 2 0.556400 8.051960 7.927860 9.666640 # H
188
166 56 1 -1.112800 0.717537 7.543310 9.627180 # O
189
167 56 2 0.556400 0.228081 8.210400 10.105500 # H
190
168 56 2 0.556400 0.266932 6.740440 9.750090 # H
191
169 57 1 -1.112800 10.591100 0.623171 1.865850 # O
192
170 57 2 0.556400 10.652000 1.452080 2.386840 # H
193
171 57 2 0.556400 9.783430 0.698423 1.363370 # H
194
172 58 1 -1.112800 7.938210 5.958010 1.384490 # O
195
173 58 2 0.556400 7.761390 5.536490 2.192400 # H
196
174 58 2 0.556400 7.064090 6.249180 1.117290 # H
197
175 59 1 -1.112800 4.821800 3.105970 7.521330 # O
198
176 59 2 0.556400 5.280230 2.334520 7.062320 # H
199
177 59 2 0.556400 4.472030 3.743860 6.875430 # H
200
178 60 1 -1.112800 4.496900 8.048400 4.270050 # O
201
179 60 2 0.556400 3.940060 8.538270 4.870210 # H
202
180 60 2 0.556400 5.255640 8.647290 4.082050 # H
203
181 61 1 -1.112800 11.300500 4.664560 7.618120 # O
204
182 61 2 0.556400 11.339900 3.754300 7.379660 # H
205
183 61 2 0.556400 11.049300 5.095730 6.782970 # H
206
184 62 1 -1.112800 11.510900 3.596380 12.157800 # O
207
185 62 2 0.556400 12.128900 3.876530 12.911516 # H
208
186 62 2 0.556400 10.542300 3.585180 12.332377 # H
209
187 63 1 -1.112800 2.566340 3.003840 9.021310 # O
210
188 63 2 0.556400 3.424460 2.785510 8.628220 # H
211
189 63 2 0.556400 1.892970 2.412700 8.700380 # H
212
190 64 1 -1.112800 3.356960 8.132790 9.544550 # O
213
191 64 2 0.556400 2.459540 7.801110 9.736580 # H
214
192 64 2 0.556400 3.866730 7.387220 9.753740 # H