0 mol 7 unq 0 iso 0 dist 6.02702 15.9584 9.97624 14.9635 10.1959 7.45262 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.02702 15.9584 9.97624 19.2937 13.9514 6.96586 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.72114 10.515 9.97624 5.72491 10.1959 7.45262 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 8.72114 10.515 9.97624 9.67579 13.9514 6.96586 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 9.62394 5.60154 9.57198 9.78006 7.28672 8.04924 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 9.01548 4.70708 6.63839 6.6492 9.12941 8.5404 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 6.46104 11.0099 7.3022 10.4035 5.30297 7.61055 numMergedOcc 0
7 mol 26 unq 1 iso 0 dist 7.36856 4.74747 7.3022 8.6385 5.30297 7.61055 numMergedOcc 0
8 mol 41 unq 0 iso 0 dist 8.51663 5.0364 6.42834 9.57606 4.85777 5.52067 numMergedOcc 0
9 mol 58 unq 0 iso 0 dist 8.80614 6.47744 9.11258 10.5365 13.9844 7.93481 numMergedOcc 0
10 mol 62 unq 0 iso 0 dist 7.56205 11.7069 6.04903 15.0857 7.97193 9.87677 numMergedOcc 0
11 mol 62 unq 1 iso 0 dist 4.74544 5.49555 6.04903 10.9202 7.97193 9.87677 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 5.37007 9.97281 7.1539 10.4448 7.75408 9.28578 numMergedOcc 0
13 mol 92 unq 1 iso 0 dist 6.95572 6.99832 5.39745 12.3604 12.1199 9.28578 numMergedOcc 0
14 mol 114 unq 0 iso 0 dist 6.84011 5.31367 8.809 6.34525 8.51024 8.06525 numMergedOcc 0
15 mol 130 unq 0 iso 0 dist 9.72053 6.01663 6.90634 10.7041 6.85776 7.62145 numMergedOcc 0
16 mol 130 unq 1 iso 0 dist 7.7949 12.8559 6.90634 14.4548 6.85776 7.62145 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 9.22232 12.0863 8.21165 16.5366 9.78763 8.07135 numMergedOcc 0
18 mol 133 unq 1 iso 0 dist 9.22661 4.68409 6.51868 12.2715 4.35684 9.4062 numMergedOcc 0
19 mol 133 unq 2 iso 0 dist 7.56378 4.68409 7.34698 12.2715 11.668 9.4062 numMergedOcc 0
20 mol 134 unq 0 iso 0 dist 9.14926 14.0712 8.84087 16.3188 7.33607 8.27673 numMergedOcc 0
21 mol 134 unq 1 iso 0 dist 9.14926 11.9684 6.32615 16.3188 7.33607 7.74431 numMergedOcc 0
22 mol 143 unq 0 iso 0 dist 7.78652 6.01455 6.46089 7.63338 11.5146 8.1582 numMergedOcc 0
23 mol 143 unq 1 iso 0 dist 7.78652 6.01455 6.46089 7.25673 6.60479 7.88655 numMergedOcc 0
24 mol 146 unq 0 iso 0 dist 8.84535 14.7359 9.44952 9.80351 6.00811 8.68349 numMergedOcc 0
25 mol 146 unq 1 iso 0 dist 8.82188 7.00857 9.44952 9.52033 6.00811 8.68349 numMergedOcc 0
26 mol 148 unq 0 iso 0 dist 9.91993 10.2478 8.73468 9.74542 7.23332 8.12589 numMergedOcc 0
27 mol 148 unq 1 iso 0 dist 9.99156 6.84291 8.73468 11.214 7.23332 8.12589 numMergedOcc 0
28 mol 148 unq 2 iso 0 dist 6.22055 10.2478 9.73927 9.74542 7.89336 8.12589 numMergedOcc 0
29 mol 148 unq 3 iso 0 dist 8.18085 6.84291 9.73927 11.214 7.89336 8.12589 numMergedOcc 0
30 mol 150 unq 0 iso 0 dist 9.96691 10.2318 8.73558 9.6606 7.35366 8.11592 numMergedOcc 0
31 mol 150 unq 1 iso 0 dist 9.8656 6.79619 8.73558 11.0682 7.35366 8.11592 numMergedOcc 0
32 mol 150 unq 2 iso 0 dist 6.14675 10.2318 9.66129 9.6606 7.86976 8.11592 numMergedOcc 0
33 mol 150 unq 3 iso 0 dist 7.94889 6.79619 9.66129 11.0682 7.86976 8.11592 numMergedOcc 0
34 mol 156 unq 0 iso 0 dist 7.30357 5.07967 7.30946 7.73169 8.40261 7.04913 numMergedOcc 0
35 mol 159 unq 0 iso 0 dist 8.4858 4.57561 5.9032 7.25742 7.97232 7.13269 numMergedOcc 0
36 mol 181 unq 0 iso 0 dist 6.59025 7.07409 6.32777 15.2991 11.1881 9.52987 numMergedOcc 0
37 mol 181 unq 1 iso 0 dist 5.9176 9.60512 5.97685 11.6558 6.12563 5.49808 numMergedOcc 0
38 mol 181 unq 2 iso 0 dist 5.9176 13.3389 8.9289 11.6558 6.12563 7.96291 numMergedOcc 0
39 mol 186 unq 0 iso 0 dist 7.76163 10.5203 9.84492 6.72641 6.71237 9.59034 numMergedOcc 0
40 mol 186 unq 1 iso 0 dist 8.73217 11.7299 9.84492 14.713 6.71237 9.59034 numMergedOcc 0
41 mol 188 unq 0 iso 0 dist 8.10214 12.0548 9.33696 8.57261 5.87427 7.48284 numMergedOcc 0
42 mol 192 unq 0 iso 0 dist 8.77999 5.71262 7.33225 7.24199 3.86183 8.53433 numMergedOcc 0
43 mol 194 unq 0 iso 0 dist 6.72379 5.38925 9.3402 8.83356 7.50057 9.77862 numMergedOcc 0
44 mol 227 unq 0 iso 0 dist 5.41321 6.43754 7.57454 8.03442 4.59123 7.1372 numMergedOcc 0
45 mol 237 unq 0 iso 0 dist 9.16003 13.7089 9.27395 12.9119 5.90415 7.33613 numMergedOcc 0
46 mol 237 unq 1 iso 0 dist 6.99315 10.1861 7.55103 12.6182 9.2471 7.33613 numMergedOcc 0
47 mol 237 unq 2 iso 0 dist 9.60163 9.10323 7.55103 14.1101 9.2471 7.33613 numMergedOcc 0
48 mol 238 unq 0 iso 0 dist 7.57812 13.0842 6.87131 6.66971 4.77308 9.42618 numMergedOcc 0
49 mol 238 unq 1 iso 0 dist 9.24557 8.85181 6.87131 7.32982 4.77308 9.42618 numMergedOcc 0
50 mol 238 unq 2 iso 0 dist 8.69104 13.0842 9.69818 6.66971 10.2777 9.42618 numMergedOcc 0
51 mol 259 unq 0 iso 0 dist 7.98231 11.6195 8.71497 10.5803 6.31909 6.39918 numMergedOcc 0
52 mol 259 unq 1 iso 0 dist 7.08526 5.79468 8.71497 8.55558 6.31909 6.39918 numMergedOcc 0
53 mol 264 unq 0 iso 0 dist 5.93616 9.67998 7.34094 11.0622 6.67381 6.5422 numMergedOcc 0
