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1 mol 8 unq 0 iso 1 dist 7.03958 10.9495 7.18019 12.4076 8.53529 8.4069 numMergedOcc 0
2 mol 8 unq 0 iso 2 dist 8.53529 12.4076 7.03958 8.4069 7.18019 10.9495 numMergedOcc 0
3 mol 8 unq 0 iso 3 dist 8.53529 8.4069 7.18019 12.4076 7.03958 10.9495 numMergedOcc 0
4 mol 8 unq 0 iso 4 dist 7.18019 10.9495 7.03958 8.4069 8.53529 12.4076 numMergedOcc 0
5 mol 8 unq 0 iso 5 dist 7.18019 8.4069 8.53529 10.9495 7.03958 12.4076 numMergedOcc 0
6 mol 8 unq 1 iso 0 dist 7.03958 12.4076 8.53529 8.09332 8.44009 12.9016 numMergedOcc 0
7 mol 8 unq 1 iso 1 dist 7.03958 8.09332 8.44009 12.4076 8.53529 12.9016 numMergedOcc 0
8 mol 8 unq 1 iso 2 dist 8.53529 12.4076 7.03958 12.9016 8.44009 8.09332 numMergedOcc 0
9 mol 8 unq 1 iso 3 dist 8.53529 12.9016 8.44009 12.4076 7.03958 8.09332 numMergedOcc 0
10 mol 8 unq 1 iso 4 dist 8.44009 8.09332 7.03958 12.9016 8.53529 12.4076 numMergedOcc 0
11 mol 8 unq 1 iso 5 dist 8.44009 12.9016 8.53529 8.09332 7.03958 12.4076 numMergedOcc 0
12 mol 8 unq 1 iso 0 dist 7.03958 10.9495 7.18019 8.09332 8.44009 6.23795 numMergedOcc 0
13 mol 8 unq 1 iso 1 dist 7.03958 8.09332 8.44009 10.9495 7.18019 6.23795 numMergedOcc 0
14 mol 8 unq 1 iso 2 dist 7.18019 10.9495 7.03958 6.23795 8.44009 8.09332 numMergedOcc 0
15 mol 8 unq 1 iso 3 dist 7.18019 6.23795 8.44009 10.9495 7.03958 8.09332 numMergedOcc 0
16 mol 8 unq 1 iso 4 dist 8.44009 8.09332 7.03958 6.23795 7.18019 10.9495 numMergedOcc 0
17 mol 8 unq 1 iso 5 dist 8.44009 6.23795 7.18019 8.09332 7.03958 10.9495 numMergedOcc 0
18 mol 8 unq 1 iso 0 dist 8.53529 8.4069 7.18019 12.9016 8.44009 6.23795 numMergedOcc 0
19 mol 8 unq 1 iso 1 dist 8.53529 12.9016 8.44009 8.4069 7.18019 6.23795 numMergedOcc 0
20 mol 8 unq 1 iso 2 dist 7.18019 8.4069 8.53529 6.23795 8.44009 12.9016 numMergedOcc 0
21 mol 8 unq 1 iso 3 dist 7.18019 6.23795 8.44009 8.4069 8.53529 12.9016 numMergedOcc 0
22 mol 8 unq 1 iso 4 dist 8.44009 12.9016 8.53529 6.23795 7.18019 8.4069 numMergedOcc 0
23 mol 8 unq 1 iso 5 dist 8.44009 6.23795 7.18019 12.9016 8.53529 8.4069 numMergedOcc 0
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25 mol 9 unq 0 iso 1 dist 7.32257 10.5747 8.64915 6.14147 6.55811 5.06358 numMergedOcc 0
26 mol 9 unq 0 iso 2 dist 6.55811 6.14147 7.32257 5.06358 8.64915 10.5747 numMergedOcc 0
27 mol 9 unq 0 iso 3 dist 6.55811 5.06358 8.64915 6.14147 7.32257 10.5747 numMergedOcc 0
28 mol 9 unq 0 iso 4 dist 8.64915 10.5747 7.32257 5.06358 6.55811 6.14147 numMergedOcc 0
29 mol 9 unq 0 iso 5 dist 8.64915 5.06358 6.55811 10.5747 7.32257 6.14147 numMergedOcc 0
30 mol 24 unq 0 iso 0 dist 8.4051 15.5315 7.29868 14.6259 8.60554 10.0952 numMergedOcc 0
31 mol 24 unq 0 iso 1 dist 8.4051 14.6259 8.60554 15.5315 7.29868 10.0952 numMergedOcc 0
32 mol 24 unq 0 iso 2 dist 7.29868 15.5315 8.4051 10.0952 8.60554 14.6259 numMergedOcc 0
33 mol 24 unq 0 iso 3 dist 7.29868 10.0952 8.60554 15.5315 8.4051 14.6259 numMergedOcc 0
34 mol 24 unq 0 iso 4 dist 8.60554 14.6259 8.4051 10.0952 7.29868 15.5315 numMergedOcc 0
35 mol 24 unq 0 iso 5 dist 8.60554 10.0952 7.29868 14.6259 8.4051 15.5315 numMergedOcc 0
36 mol 25 unq 0 iso 0 dist 8.87757 15.5644 8.50222 16.1048 7.55264 4.33106 numMergedOcc 0
37 mol 25 unq 0 iso 1 dist 8.87757 16.1048 7.55264 15.5644 8.50222 4.33106 numMergedOcc 0
38 mol 25 unq 0 iso 2 dist 8.50222 15.5644 8.87757 4.33106 7.55264 16.1048 numMergedOcc 0
39 mol 25 unq 0 iso 3 dist 8.50222 4.33106 7.55264 15.5644 8.87757 16.1048 numMergedOcc 0
40 mol 25 unq 0 iso 4 dist 7.55264 16.1048 8.87757 4.33106 8.50222 15.5644 numMergedOcc 0
41 mol 25 unq 0 iso 5 dist 7.55264 4.33106 8.50222 16.1048 8.87757 15.5644 numMergedOcc 0
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43 mol 58 unq 0 iso 1 dist 9.92355 5.35073 7.68678 5.30792 5.93884 4.81926 numMergedOcc 0
44 mol 58 unq 0 iso 2 dist 5.93884 5.30792 9.92355 4.81926 7.68678 5.35073 numMergedOcc 0
45 mol 58 unq 0 iso 3 dist 5.93884 4.81926 7.68678 5.30792 9.92355 5.35073 numMergedOcc 0
46 mol 58 unq 0 iso 4 dist 7.68678 5.35073 9.92355 4.81926 5.93884 5.30792 numMergedOcc 0
47 mol 58 unq 0 iso 5 dist 7.68678 4.81926 5.93884 5.35073 9.92355 5.30792 numMergedOcc 0
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49 mol 65 unq 0 iso 1 dist 7.90294 10.2941 8.22785 14.4691 9.34791 5.48814 numMergedOcc 0
50 mol 65 unq 0 iso 2 dist 9.34791 14.4691 7.90294 5.48814 8.22785 10.2941 numMergedOcc 0
51 mol 65 unq 0 iso 3 dist 9.34791 5.48814 8.22785 14.4691 7.90294 10.2941 numMergedOcc 0
52 mol 65 unq 0 iso 4 dist 8.22785 10.2941 7.90294 5.48814 9.34791 14.4691 numMergedOcc 0
53 mol 65 unq 0 iso 5 dist 8.22785 5.48814 9.34791 10.2941 7.90294 14.4691 numMergedOcc 0
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55 mol 92 unq 0 iso 1 dist 5.9465 9.35561 9.95342 5.04493 6.97962 12.7769 numMergedOcc 0
56 mol 92 unq 0 iso 2 dist 6.97962 5.04493 5.9465 12.7769 9.95342 9.35561 numMergedOcc 0
57 mol 92 unq 0 iso 3 dist 6.97962 12.7769 9.95342 5.04493 5.9465 9.35561 numMergedOcc 0
58 mol 92 unq 0 iso 4 dist 9.95342 9.35561 5.9465 12.7769 6.97962 5.04493 numMergedOcc 0
59 mol 92 unq 0 iso 5 dist 9.95342 12.7769 6.97962 9.35561 5.9465 5.04493 numMergedOcc 0
60 mol 98 unq 0 iso 0 dist 5.78706 7.51619 7.23884 10.6225 5.59328 11.4338 numMergedOcc 0
61 mol 98 unq 0 iso 1 dist 5.78706 10.6225 5.59328 7.51619 7.23884 11.4338 numMergedOcc 0
62 mol 98 unq 0 iso 2 dist 7.23884 7.51619 5.78706 11.4338 5.59328 10.6225 numMergedOcc 0
63 mol 98 unq 0 iso 3 dist 7.23884 11.4338 5.59328 7.51619 5.78706 10.6225 numMergedOcc 0
64 mol 98 unq 0 iso 4 dist 5.59328 10.6225 5.78706 11.4338 7.23884 7.51619 numMergedOcc 0
65 mol 98 unq 0 iso 5 dist 5.59328 11.4338 7.23884 10.6225 5.78706 7.51619 numMergedOcc 0
66 mol 98 unq 1 iso 0 dist 5.78706 7.51619 7.23884 12.7411 7.5242 9.30161 numMergedOcc 0
67 mol 98 unq 1 iso 1 dist 5.78706 12.7411 7.5242 7.51619 7.23884 9.30161 numMergedOcc 0
68 mol 98 unq 1 iso 2 dist 7.23884 7.51619 5.78706 9.30161 7.5242 12.7411 numMergedOcc 0
69 mol 98 unq 1 iso 3 dist 7.23884 9.30161 7.5242 7.51619 5.78706 12.7411 numMergedOcc 0
70 mol 98 unq 1 iso 4 dist 7.5242 12.7411 5.78706 9.30161 7.23884 7.51619 numMergedOcc 0
71 mol 98 unq 1 iso 5 dist 7.5242 9.30161 7.23884 12.7411 5.78706 7.51619 numMergedOcc 0
72 mol 98 unq 1 iso 0 dist 5.78706 10.6225 5.59328 12.7411 7.5242 7.72877 numMergedOcc 0
73 mol 98 unq 1 iso 1 dist 5.78706 12.7411 7.5242 10.6225 5.59328 7.72877 numMergedOcc 0
74 mol 98 unq 1 iso 2 dist 5.59328 10.6225 5.78706 7.72877 7.5242 12.7411 numMergedOcc 0
75 mol 98 unq 1 iso 3 dist 5.59328 7.72877 7.5242 10.6225 5.78706 12.7411 numMergedOcc 0
76 mol 98 unq 1 iso 4 dist 7.5242 12.7411 5.78706 7.72877 5.59328 10.6225 numMergedOcc 0
77 mol 98 unq 1 iso 5 dist 7.5242 7.72877 5.59328 12.7411 5.78706 10.6225 numMergedOcc 0
78 mol 98 unq 2 iso 0 dist 6.7117 8.40073 4.47349 10.2427 5.65185 5.02887 numMergedOcc 0
79 mol 98 unq 2 iso 1 dist 6.7117 10.2427 5.65185 8.40073 4.47349 5.02887 numMergedOcc 0
80 mol 98 unq 2 iso 2 dist 4.47349 8.40073 6.7117 5.02887 5.65185 10.2427 numMergedOcc 0
81 mol 98 unq 2 iso 3 dist 4.47349 5.02887 5.65185 8.40073 6.7117 10.2427 numMergedOcc 0
82 mol 98 unq 2 iso 4 dist 5.65185 10.2427 6.7117 5.02887 4.47349 8.40073 numMergedOcc 0
83 mol 98 unq 2 iso 5 dist 5.65185 5.02887 4.47349 10.2427 6.7117 8.40073 numMergedOcc 0
84 mol 98 unq 1 iso 0 dist 7.23884 11.4338 5.59328 9.30161 7.5242 7.72877 numMergedOcc 0
85 mol 98 unq 1 iso 1 dist 7.23884 9.30161 7.5242 11.4338 5.59328 7.72877 numMergedOcc 0
86 mol 98 unq 1 iso 2 dist 5.59328 11.4338 7.23884 7.72877 7.5242 9.30161 numMergedOcc 0
87 mol 98 unq 1 iso 3 dist 5.59328 7.72877 7.5242 11.4338 7.23884 9.30161 numMergedOcc 0
88 mol 98 unq 1 iso 4 dist 7.5242 9.30161 7.23884 7.72877 5.59328 11.4338 numMergedOcc 0
89 mol 98 unq 1 iso 5 dist 7.5242 7.72877 5.59328 9.30161 7.23884 11.4338 numMergedOcc 0
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91 mol 115 unq 0 iso 1 dist 6.92026 10.5564 6.97707 6.5838 5.88249 5.67807 numMergedOcc 0
92 mol 115 unq 0 iso 2 dist 5.88249 6.5838 6.92026 5.67807 6.97707 10.5564 numMergedOcc 0
93 mol 115 unq 0 iso 3 dist 5.88249 5.67807 6.97707 6.5838 6.92026 10.5564 numMergedOcc 0
94 mol 115 unq 0 iso 4 dist 6.97707 10.5564 6.92026 5.67807 5.88249 6.5838 numMergedOcc 0
95 mol 115 unq 0 iso 5 dist 6.97707 5.67807 5.88249 10.5564 6.92026 6.5838 numMergedOcc 0
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97 mol 125 unq 0 iso 1 dist 9.08382 9.34412 7.47069 5.20403 9.3778 11.8325 numMergedOcc 0
98 mol 125 unq 0 iso 2 dist 9.3778 5.20403 9.08382 11.8325 7.47069 9.34412 numMergedOcc 0
99 mol 125 unq 0 iso 3 dist 9.3778 11.8325 7.47069 5.20403 9.08382 9.34412 numMergedOcc 0
100 mol 125 unq 0 iso 4 dist 7.47069 9.34412 9.08382 11.8325 9.3778 5.20403 numMergedOcc 0
101 mol 125 unq 0 iso 5 dist 7.47069 11.8325 9.3778 9.34412 9.08382 5.20403 numMergedOcc 0
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103 mol 130 unq 0 iso 1 dist 8.78276 8.38345 7.96646 4.5207 7.88805 10.0969 numMergedOcc 0
104 mol 130 unq 0 iso 2 dist 7.88805 4.5207 8.78276 10.0969 7.96646 8.38345 numMergedOcc 0
105 mol 130 unq 0 iso 3 dist 7.88805 10.0969 7.96646 4.5207 8.78276 8.38345 numMergedOcc 0
106 mol 130 unq 0 iso 4 dist 7.96646 8.38345 8.78276 10.0969 7.88805 4.5207 numMergedOcc 0
107 mol 130 unq 0 iso 5 dist 7.96646 10.0969 7.88805 8.38345 8.78276 4.5207 numMergedOcc 0
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109 mol 130 unq 1 iso 1 dist 8.78276 10.5137 7.90048 4.5207 7.88805 7.01619 numMergedOcc 0
110 mol 130 unq 1 iso 2 dist 7.88805 4.5207 8.78276 7.01619 7.90048 10.5137 numMergedOcc 0
111 mol 130 unq 1 iso 3 dist 7.88805 7.01619 7.90048 4.5207 8.78276 10.5137 numMergedOcc 0
112 mol 130 unq 1 iso 4 dist 7.90048 10.5137 8.78276 7.01619 7.88805 4.5207 numMergedOcc 0
113 mol 130 unq 1 iso 5 dist 7.90048 7.01619 7.88805 10.5137 8.78276 4.5207 numMergedOcc 0
114 mol 130 unq 1 iso 0 dist 8.78276 8.38345 7.96646 10.5137 7.90048 10.7116 numMergedOcc 0
115 mol 130 unq 1 iso 1 dist 8.78276 10.5137 7.90048 8.38345 7.96646 10.7116 numMergedOcc 0
116 mol 130 unq 1 iso 2 dist 7.96646 8.38345 8.78276 10.7116 7.90048 10.5137 numMergedOcc 0
117 mol 130 unq 1 iso 3 dist 7.96646 10.7116 7.90048 8.38345 8.78276 10.5137 numMergedOcc 0
118 mol 130 unq 1 iso 4 dist 7.90048 10.5137 8.78276 10.7116 7.96646 8.38345 numMergedOcc 0
119 mol 130 unq 1 iso 5 dist 7.90048 10.7116 7.96646 10.5137 8.78276 8.38345 numMergedOcc 0
120 mol 130 unq 1 iso 0 dist 7.88805 10.0969 7.96646 7.01619 7.90048 10.7116 numMergedOcc 0
121 mol 130 unq 1 iso 1 dist 7.88805 7.01619 7.90048 10.0969 7.96646 10.7116 numMergedOcc 0
122 mol 130 unq 1 iso 2 dist 7.96646 10.0969 7.88805 10.7116 7.90048 7.01619 numMergedOcc 0
123 mol 130 unq 1 iso 3 dist 7.96646 10.7116 7.90048 10.0969 7.88805 7.01619 numMergedOcc 0
124 mol 130 unq 1 iso 4 dist 7.90048 7.01619 7.88805 10.7116 7.96646 10.0969 numMergedOcc 0
125 mol 130 unq 1 iso 5 dist 7.90048 10.7116 7.96646 7.01619 7.88805 10.0969 numMergedOcc 0
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127 mol 133 unq 0 iso 1 dist 9.97654 6.761 7.71248 6.69554 6.66772 7.6656 numMergedOcc 0
128 mol 133 unq 0 iso 2 dist 6.66772 6.69554 9.97654 7.6656 7.71248 6.761 numMergedOcc 0
129 mol 133 unq 0 iso 3 dist 6.66772 7.6656 7.71248 6.69554 9.97654 6.761 numMergedOcc 0
130 mol 133 unq 0 iso 4 dist 7.71248 6.761 9.97654 7.6656 6.66772 6.69554 numMergedOcc 0
131 mol 133 unq 0 iso 5 dist 7.71248 7.6656 6.66772 6.761 9.97654 6.69554 numMergedOcc 0
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133 mol 134 unq 0 iso 1 dist 7.69991 11.3271 9.94764 5.00526 6.23142 6.81259 numMergedOcc 0
134 mol 134 unq 0 iso 2 dist 6.23142 5.00526 7.69991 6.81259 9.94764 11.3271 numMergedOcc 0
135 mol 134 unq 0 iso 3 dist 6.23142 6.81259 9.94764 5.00526 7.69991 11.3271 numMergedOcc 0
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137 mol 134 unq 0 iso 5 dist 9.94764 6.81259 6.23142 11.3271 7.69991 5.00526 numMergedOcc 0
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139 mol 171 unq 0 iso 1 dist 6.64834 11.6409 8.24693 4.91149 5.93786 7.31409 numMergedOcc 0
140 mol 171 unq 0 iso 2 dist 5.93786 4.91149 6.64834 7.31409 8.24693 11.6409 numMergedOcc 0
141 mol 171 unq 0 iso 3 dist 5.93786 7.31409 8.24693 4.91149 6.64834 11.6409 numMergedOcc 0
142 mol 171 unq 0 iso 4 dist 8.24693 11.6409 6.64834 7.31409 5.93786 4.91149 numMergedOcc 0
143 mol 171 unq 0 iso 5 dist 8.24693 7.31409 5.93786 11.6409 6.64834 4.91149 numMergedOcc 0
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145 mol 171 unq 1 iso 1 dist 6.64834 5.51687 7.36698 4.91149 5.93786 8.07119 numMergedOcc 0
146 mol 171 unq 1 iso 2 dist 5.93786 4.91149 6.64834 8.07119 7.36698 5.51687 numMergedOcc 0
147 mol 171 unq 1 iso 3 dist 5.93786 8.07119 7.36698 4.91149 6.64834 5.51687 numMergedOcc 0
148 mol 171 unq 1 iso 4 dist 7.36698 5.51687 6.64834 8.07119 5.93786 4.91149 numMergedOcc 0
149 mol 171 unq 1 iso 5 dist 7.36698 8.07119 5.93786 5.51687 6.64834 4.91149 numMergedOcc 0
150 mol 171 unq 1 iso 0 dist 6.64834 11.6409 8.24693 5.51687 7.36698 14.1033 numMergedOcc 0
151 mol 171 unq 1 iso 1 dist 6.64834 5.51687 7.36698 11.6409 8.24693 14.1033 numMergedOcc 0
152 mol 171 unq 1 iso 2 dist 8.24693 11.6409 6.64834 14.1033 7.36698 5.51687 numMergedOcc 0
153 mol 171 unq 1 iso 3 dist 8.24693 14.1033 7.36698 11.6409 6.64834 5.51687 numMergedOcc 0
154 mol 171 unq 1 iso 4 dist 7.36698 5.51687 6.64834 14.1033 8.24693 11.6409 numMergedOcc 0
155 mol 171 unq 1 iso 5 dist 7.36698 14.1033 8.24693 5.51687 6.64834 11.6409 numMergedOcc 0
156 mol 171 unq 1 iso 0 dist 5.93786 7.31409 8.24693 8.07119 7.36698 14.1033 numMergedOcc 0
157 mol 171 unq 1 iso 1 dist 5.93786 8.07119 7.36698 7.31409 8.24693 14.1033 numMergedOcc 0
158 mol 171 unq 1 iso 2 dist 8.24693 7.31409 5.93786 14.1033 7.36698 8.07119 numMergedOcc 0
159 mol 171 unq 1 iso 3 dist 8.24693 14.1033 7.36698 7.31409 5.93786 8.07119 numMergedOcc 0
160 mol 171 unq 1 iso 4 dist 7.36698 8.07119 5.93786 14.1033 8.24693 7.31409 numMergedOcc 0
161 mol 171 unq 1 iso 5 dist 7.36698 14.1033 8.24693 8.07119 5.93786 7.31409 numMergedOcc 0
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163 mol 181 unq 0 iso 1 dist 6.2479 8.88798 7.99195 6.01247 6.22122 12.6324 numMergedOcc 0
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165 mol 181 unq 0 iso 3 dist 6.22122 12.6324 7.99195 6.01247 6.2479 8.88798 numMergedOcc 0
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167 mol 181 unq 0 iso 5 dist 7.99195 12.6324 6.22122 8.88798 6.2479 6.01247 numMergedOcc 0
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169 mol 235 unq 0 iso 1 dist 6.36341 10.5547 9.21736 8.31875 6.21292 4.53064 numMergedOcc 0
170 mol 235 unq 0 iso 2 dist 6.21292 8.31875 6.36341 4.53064 9.21736 10.5547 numMergedOcc 0
171 mol 235 unq 0 iso 3 dist 6.21292 4.53064 9.21736 8.31875 6.36341 10.5547 numMergedOcc 0
172 mol 235 unq 0 iso 4 dist 9.21736 10.5547 6.36341 4.53064 6.21292 8.31875 numMergedOcc 0
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179 mol 238 unq 0 iso 5 dist 8.67864 5.31152 7.02333 8.87326 8.94014 5.6348 numMergedOcc 0
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181 mol 258 unq 0 iso 1 dist 9.63959 12.321 7.21311 12.4198 9.96262 10.7374 numMergedOcc 0
182 mol 258 unq 0 iso 2 dist 9.96262 12.4198 9.63959 10.7374 7.21311 12.321 numMergedOcc 0
183 mol 258 unq 0 iso 3 dist 9.96262 10.7374 7.21311 12.4198 9.63959 12.321 numMergedOcc 0
184 mol 258 unq 0 iso 4 dist 7.21311 12.321 9.63959 10.7374 9.96262 12.4198 numMergedOcc 0
185 mol 258 unq 0 iso 5 dist 7.21311 10.7374 9.96262 12.321 9.63959 12.4198 numMergedOcc 0
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187 mol 274 unq 0 iso 1 dist 7.46394 14.3919 8.91672 10.501 9.45514 11.7196 numMergedOcc 0
188 mol 274 unq 0 iso 2 dist 9.45514 10.501 7.46394 11.7196 8.91672 14.3919 numMergedOcc 0
189 mol 274 unq 0 iso 3 dist 9.45514 11.7196 8.91672 10.501 7.46394 14.3919 numMergedOcc 0
190 mol 274 unq 0 iso 4 dist 8.91672 14.3919 7.46394 11.7196 9.45514 10.501 numMergedOcc 0
191 mol 274 unq 0 iso 5 dist 8.91672 11.7196 9.45514 14.3919 7.46394 10.501 numMergedOcc 0
192 mol 274 unq 1 iso 0 dist 7.46394 10.501 9.45514 6.15918 7.1729 6.828 numMergedOcc 0
193 mol 274 unq 1 iso 1 dist 7.46394 6.15918 7.1729 10.501 9.45514 6.828 numMergedOcc 0
194 mol 274 unq 1 iso 2 dist 9.45514 10.501 7.46394 6.828 7.1729 6.15918 numMergedOcc 0
195 mol 274 unq 1 iso 3 dist 9.45514 6.828 7.1729 10.501 7.46394 6.15918 numMergedOcc 0
196 mol 274 unq 1 iso 4 dist 7.1729 6.15918 7.46394 6.828 9.45514 10.501 numMergedOcc 0
197 mol 274 unq 1 iso 5 dist 7.1729 6.828 9.45514 6.15918 7.46394 10.501 numMergedOcc 0
198 mol 274 unq 1 iso 0 dist 7.46394 14.3919 8.91672 6.15918 7.1729 10.0083 numMergedOcc 0
199 mol 274 unq 1 iso 1 dist 7.46394 6.15918 7.1729 14.3919 8.91672 10.0083 numMergedOcc 0
200 mol 274 unq 1 iso 2 dist 8.91672 14.3919 7.46394 10.0083 7.1729 6.15918 numMergedOcc 0
201 mol 274 unq 1 iso 3 dist 8.91672 10.0083 7.1729 14.3919 7.46394 6.15918 numMergedOcc 0
202 mol 274 unq 1 iso 4 dist 7.1729 6.15918 7.46394 10.0083 8.91672 14.3919 numMergedOcc 0
203 mol 274 unq 1 iso 5 dist 7.1729 10.0083 8.91672 6.15918 7.46394 14.3919 numMergedOcc 0
204 mol 274 unq 1 iso 0 dist 9.45514 11.7196 8.91672 6.828 7.1729 10.0083 numMergedOcc 0
205 mol 274 unq 1 iso 1 dist 9.45514 6.828 7.1729 11.7196 8.91672 10.0083 numMergedOcc 0
206 mol 274 unq 1 iso 2 dist 8.91672 11.7196 9.45514 10.0083 7.1729 6.828 numMergedOcc 0
207 mol 274 unq 1 iso 3 dist 8.91672 10.0083 7.1729 11.7196 9.45514 6.828 numMergedOcc 0
208 mol 274 unq 1 iso 4 dist 7.1729 6.828 9.45514 10.0083 8.91672 11.7196 numMergedOcc 0
209 mol 274 unq 1 iso 5 dist 7.1729 10.0083 8.91672 6.828 9.45514 11.7196 numMergedOcc 0
