0 mol 7 unq 0 iso 0 dist 9.67498 10.2939 8.85869 13.5103 5.38328 7.5298 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.67498 10.2939 8.85869 15.5636 9.19359 7.87568 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.32945 15.279 8.85869 9.90117 5.38328 7.5298 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 9.32945 15.279 8.85869 14.766 9.19359 7.87568 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 9.90117 15.279 7.5298 9.32945 5.38328 8.85869 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 9.90117 15.279 7.5298 14.766 5.02731 7.87568 numMergedOcc 0
6 mol 12 unq 0 iso 0 dist 8.98466 8.5421 7.96154 14.8497 7.10076 9.64703 numMergedOcc 0
7 mol 55 unq 0 iso 0 dist 7.58788 6.63489 5.62629 10.8396 5.20168 8.34632 numMergedOcc 0
8 mol 69 unq 0 iso 0 dist 7.09393 8.50938 8.51894 3.87167 3.83043 8.27592 numMergedOcc 0
9 mol 69 unq 1 iso 0 dist 3.87167 8.50938 8.27592 7.09393 3.83043 8.51894 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 5.39171 6.13631 7.84699 9.27355 5.47475 8.40844 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 5.39171 6.13631 7.84699 8.60363 5.05066 6.99156 numMergedOcc 0
12 mol 73 unq 2 iso 0 dist 5.39171 12.6081 7.53504 9.27355 5.47475 8.66342 numMergedOcc 0
13 mol 73 unq 3 iso 0 dist 5.39171 12.6081 7.53504 8.60363 5.05066 7.21285 numMergedOcc 0
14 mol 73 unq 4 iso 0 dist 5.39171 12.6081 7.53504 12.4571 9.51715 6.95094 numMergedOcc 0
15 mol 73 unq 5 iso 0 dist 9.27355 6.13631 8.40844 5.39171 5.47475 7.84699 numMergedOcc 0
16 mol 73 unq 6 iso 0 dist 9.27355 6.13631 8.40844 8.60363 4.4628 6.99156 numMergedOcc 0
17 mol 73 unq 7 iso 0 dist 9.27355 12.6081 8.66342 5.39171 5.47475 7.53504 numMergedOcc 0
18 mol 73 unq 8 iso 0 dist 9.27355 12.6081 8.66342 8.60363 4.4628 7.21285 numMergedOcc 0
19 mol 73 unq 9 iso 0 dist 9.27355 12.6081 8.66342 12.4571 11.6754 6.95094 numMergedOcc 0
20 mol 73 unq 10 iso 0 dist 8.60363 6.13631 6.99156 5.39171 5.05066 7.84699 numMergedOcc 0
21 mol 73 unq 11 iso 0 dist 8.60363 6.13631 6.99156 9.27355 4.4628 8.40844 numMergedOcc 0
22 mol 73 unq 12 iso 0 dist 8.60363 12.6081 7.21285 5.39171 5.05066 7.53504 numMergedOcc 0
23 mol 73 unq 13 iso 0 dist 8.60363 12.6081 7.21285 9.27355 4.4628 8.66342 numMergedOcc 0
24 mol 73 unq 14 iso 0 dist 8.60363 12.6081 7.21285 12.4571 7.64038 6.95094 numMergedOcc 0
25 mol 73 unq 15 iso 0 dist 9.27331 11.9439 6.99156 14.0106 5.05066 7.84699 numMergedOcc 0
26 mol 73 unq 16 iso 0 dist 9.27331 11.9439 6.99156 10.0291 4.4628 8.40844 numMergedOcc 0
27 mol 73 unq 17 iso 0 dist 9.27331 14.1204 7.21285 14.0106 5.05066 7.53504 numMergedOcc 0
28 mol 73 unq 18 iso 0 dist 9.27331 14.1204 7.21285 10.0291 4.4628 8.66342 numMergedOcc 0
29 mol 73 unq 19 iso 0 dist 9.27331 14.1204 7.21285 13.8777 7.64038 6.95094 numMergedOcc 0
30 mol 134 unq 0 iso 0 dist 7.85526 5.57607 7.94564 5.33543 5.63574 9.21999 numMergedOcc 0
31 mol 134 unq 1 iso 0 dist 5.33543 5.57607 9.21999 7.85526 5.63574 7.94564 numMergedOcc 0
32 mol 152 unq 0 iso 0 dist 7.53834 10.7416 7.21636 12.1625 5.72609 7.99446 numMergedOcc 0
33 mol 173 unq 0 iso 0 dist 5.97008 8.90271 7.13369 14.5609 13.1862 9.17063 numMergedOcc 0
34 mol 173 unq 1 iso 0 dist 5.97008 8.90271 7.13369 13.2446 11.2682 9.99332 numMergedOcc 0
35 mol 181 unq 0 iso 0 dist 8.78709 11.6119 5.77393 15.5964 8.67658 4.35909 numMergedOcc 0
36 mol 205 unq 0 iso 0 dist 9.89311 11.7852 5.94835 7.71155 6.26321 6.76947 numMergedOcc 0
37 mol 205 unq 1 iso 0 dist 7.71155 11.7852 6.76947 9.89311 6.26321 5.94835 numMergedOcc 0
38 mol 211 unq 0 iso 0 dist 9.8921 16.4954 9.45365 13.6015 9.23863 7.14732 numMergedOcc 0
39 mol 211 unq 1 iso 0 dist 9.8921 15.2751 7.15386 20.3523 10.7154 9.63472 numMergedOcc 0
40 mol 211 unq 2 iso 0 dist 9.8921 17.5039 7.73993 20.3523 10.7154 5.42004 numMergedOcc 0
41 mol 220 unq 0 iso 0 dist 8.23246 4.80815 7.0166 12.6228 9.1793 8.75468 numMergedOcc 0
42 mol 220 unq 1 iso 0 dist 8.94094 8.02012 7.80496 13.7482 5.5301 9.60247 numMergedOcc 0
43 mol 220 unq 2 iso 0 dist 8.94094 6.1155 8.75468 12.4003 9.1793 7.0166 numMergedOcc 0
44 mol 220 unq 3 iso 0 dist 7.57712 6.40358 4.3362 7.20255 5.88344 5.51565 numMergedOcc 0
45 mol 220 unq 4 iso 0 dist 7.20255 6.40358 5.51565 7.57712 5.88344 4.3362 numMergedOcc 0
46 mol 220 unq 5 iso 0 dist 9.35184 5.5295 7.80496 12.2835 5.5301 9.60247 numMergedOcc 0
47 mol 220 unq 6 iso 0 dist 9.35184 13.0157 8.75468 16.9765 9.1793 7.0166 numMergedOcc 0
48 mol 223 unq 0 iso 0 dist 9.29204 4.68566 9.86372 9.14789 4.44825 7.70946 numMergedOcc 0
49 mol 223 unq 1 iso 0 dist 9.14789 4.68566 7.70946 9.29204 4.44825 9.86372 numMergedOcc 0
50 mol 223 unq 2 iso 0 dist 8.78739 5.07822 7.70946 11.4492 4.44825 9.86372 numMergedOcc 0
51 mol 224 unq 0 iso 0 dist 7.47122 6.1168 7.46044 12.14 16.6444 9.92947 numMergedOcc 0
52 mol 224 unq 1 iso 0 dist 6.6537 9.80029 7.46044 19.6567 16.6444 9.92947 numMergedOcc 0
53 mol 224 unq 2 iso 0 dist 7.58998 9.07072 6.36813 11.9987 6.35724 4.99301 numMergedOcc 0
54 mol 249 unq 0 iso 0 dist 6.18866 6.59067 5.66519 9.3807 5.2966 6.50067 numMergedOcc 0
55 mol 249 unq 1 iso 0 dist 9.3807 6.59067 6.50067 6.18866 5.2966 5.66519 numMergedOcc 0
56 mol 260 unq 0 iso 0 dist 9.18439 7.86533 8.3298 12.6528 5.54154 8.66784 numMergedOcc 0
57 mol 274 unq 0 iso 0 dist 9.07452 14.9337 8.17922 22.2668 16.4367 8.26695 numMergedOcc 0
58 mol 274 unq 1 iso 0 dist 9.07452 14.9337 8.17922 18.1637 12.757 5.59151 numMergedOcc 0
59 mol 274 unq 2 iso 0 dist 7.21004 6.33183 5.68643 10.3381 4.94221 8.99974 numMergedOcc 0
60 mol 274 unq 3 iso 0 dist 7.21004 6.33183 5.68643 12.6573 6.01628 8.36043 numMergedOcc 0
61 mol 274 unq 4 iso 0 dist 6.12202 13.0534 8.05503 16.6257 11.568 9.30966 numMergedOcc 0
62 mol 274 unq 5 iso 0 dist 6.12202 13.0534 8.05503 11.8821 6.07831 5.38704 numMergedOcc 0
63 mol 274 unq 6 iso 0 dist 6.12202 9.24343 5.59151 11.8821 6.07831 8.26695 numMergedOcc 0
64 mol 274 unq 7 iso 0 dist 6.12202 9.24343 5.59151 12.988 12.757 8.17922 numMergedOcc 0
65 mol 274 unq 8 iso 0 dist 6.44266 6.26074 8.17922 12.9405 16.4367 8.26695 numMergedOcc 0
66 mol 274 unq 9 iso 0 dist 6.44266 6.26074 8.17922 10.6014 12.757 5.59151 numMergedOcc 0
67 mol 274 unq 10 iso 0 dist 8.75703 9.34663 5.68643 13.5853 4.94221 8.99974 numMergedOcc 0
68 mol 274 unq 11 iso 0 dist 8.75703 9.34663 5.68643 10.0237 6.01628 8.36043 numMergedOcc 0
69 mol 277 unq 0 iso 0 dist 6.23539 13.1 9.42812 14.8085 11.4925 8.83777 numMergedOcc 0
70 mol 279 unq 0 iso 0 dist 8.78203 12.3869 8.76889 14.3069 11.9542 6.37469 numMergedOcc 0
71 mol 280 unq 0 iso 0 dist 6.83927 6.12141 9.047 14.1785 11.5166 9.9227 numMergedOcc 0
72 mol 280 unq 1 iso 0 dist 7.3304 10.5216 9.9227 12.9293 11.5166 9.047 numMergedOcc 0
73 mol 282 unq 0 iso 0 dist 7.93511 8.96033 6.40686 13.5529 6.38894 7.14443 numMergedOcc 0
74 mol 285 unq 0 iso 0 dist 8.08495 5.8542 8.33415 12.5449 14.0317 8.78148 numMergedOcc 0
75 mol 285 unq 1 iso 0 dist 8.70702 8.66375 8.78148 9.3482 14.0317 8.33415 numMergedOcc 0
76 mol 285 unq 2 iso 0 dist 9.3482 8.66375 8.33415 8.70702 14.0317 8.78148 numMergedOcc 0
