0 mol 2 unq 0 iso 0 dist 5.42021 6.47123 9.5866 9.39095 8.35692 10.431 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 9.15006 6.47123 13.6302 9.39095 10.6458 10.431 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 9.56259 9.38983 10.2896 8.44792 14.4547 6.62276 numMergedOcc 0
3 mol 10 unq 1 iso 0 dist 9.56259 9.38983 10.2896 4.94198 7.66496 7.95312 numMergedOcc 0
4 mol 10 unq 2 iso 0 dist 9.56259 9.38983 10.2896 9.62353 8.50202 15.7095 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 7.74131 5.55798 4.20398 7.06029 6.82396 4.13187 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 8.06034 5.81553 5.73618 9.60648 3.37479 7.8359 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 9.0455 6.65878 4.74644 7.84813 3.54691 6.61102 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 7.12336 9.73038 4.98521 8.52036 5.56456 6.208 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 9.70977 8.52591 8.91809 6.41183 9.17108 10.3186 numMergedOcc 0
10 mol 163 unq 0 iso 0 dist 7.5447 9.24754 14.6044 9.37245 15.4278 5.57089 numMergedOcc 0
11 mol 163 unq 1 iso 0 dist 9.04757 9.24754 9.20952 9.37245 13.5948 5.57089 numMergedOcc 0
12 mol 168 unq 0 iso 0 dist 9.76722 5.60956 4.65845 6.48066 7.13766 3.60864 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 8.44483 6.09291 11.8115 7.50458 3.69097 10.1931 numMergedOcc 0
14 mol 169 unq 1 iso 0 dist 8.44483 6.09291 11.8115 5.79554 7.14832 10.5136 numMergedOcc 0
15 mol 169 unq 2 iso 0 dist 8.44483 6.09291 11.8115 4.22003 8.01356 10.212 numMergedOcc 0
16 mol 169 unq 3 iso 0 dist 9.79864 6.09291 12.8928 7.50458 11.5623 10.1931 numMergedOcc 0
17 mol 169 unq 4 iso 0 dist 9.79864 6.09291 12.8928 5.79554 12.6041 10.5136 numMergedOcc 0
18 mol 169 unq 5 iso 0 dist 9.79864 6.09291 12.8928 4.22003 10.4049 10.212 numMergedOcc 0
19 mol 169 unq 6 iso 0 dist 9.73241 6.09291 11.3409 7.50458 16.721 10.1931 numMergedOcc 0
20 mol 169 unq 7 iso 0 dist 9.73241 6.09291 11.3409 5.79554 14.8989 10.5136 numMergedOcc 0
21 mol 169 unq 8 iso 0 dist 9.73241 6.09291 11.3409 4.22003 11.6433 10.212 numMergedOcc 0
22 mol 185 unq 0 iso 0 dist 9.56016 8.85182 4.63469 9.1549 8.58853 4.49455 numMergedOcc 0
23 mol 185 unq 1 iso 0 dist 9.56016 5.7065 13.6086 9.1549 8.58853 9.70184 numMergedOcc 0
24 mol 185 unq 2 iso 0 dist 7.92501 8.85182 9.22587 9.1549 6.49781 4.49455 numMergedOcc 0
25 mol 185 unq 3 iso 0 dist 7.92501 5.7065 9.4687 9.1549 6.49781 9.70184 numMergedOcc 0
26 mol 192 unq 0 iso 0 dist 9.80584 5.21088 8.61606 5.05414 9.70184 3.9335 numMergedOcc 0
27 mol 192 unq 1 iso 0 dist 9.80584 5.21088 8.61606 7.16964 13.6636 5.31881 numMergedOcc 0
28 mol 192 unq 2 iso 0 dist 9.80584 9.78743 19.1942 5.05414 9.70184 10.6325 numMergedOcc 0
29 mol 192 unq 3 iso 0 dist 9.80584 9.78743 19.1942 7.16964 13.6636 7.64178 numMergedOcc 0
30 mol 192 unq 4 iso 0 dist 9.80584 8.25609 4.97164 5.05414 9.70184 10.6087 numMergedOcc 0
31 mol 192 unq 5 iso 0 dist 9.80584 8.25609 4.97164 7.16964 13.6636 13.6786 numMergedOcc 0
32 mol 192 unq 6 iso 0 dist 7.95713 5.21088 5.41356 5.05414 8.12818 3.9335 numMergedOcc 0
33 mol 192 unq 7 iso 0 dist 7.95713 5.21088 5.41356 7.16964 10.7274 5.31881 numMergedOcc 0
34 mol 192 unq 8 iso 0 dist 7.95713 9.78743 16.5293 5.05414 8.12818 10.6325 numMergedOcc 0
35 mol 192 unq 9 iso 0 dist 7.95713 9.78743 16.5293 7.16964 10.7274 7.64178 numMergedOcc 0
36 mol 192 unq 10 iso 0 dist 7.95713 8.25609 4.87986 5.05414 8.12818 10.6087 numMergedOcc 0
37 mol 192 unq 11 iso 0 dist 7.95713 8.25609 4.87986 7.16964 10.7274 13.6786 numMergedOcc 0
38 mol 210 unq 0 iso 0 dist 9.718 5.70065 10.0806 9.49242 12.6983 5.81094 numMergedOcc 0
39 mol 210 unq 1 iso 0 dist 9.718 5.70065 10.0806 9.25184 12.162 6.59517 numMergedOcc 0
40 mol 210 unq 2 iso 0 dist 8.61629 5.70065 6.89532 9.49242 9.16249 5.81094 numMergedOcc 0
41 mol 210 unq 3 iso 0 dist 8.61629 5.70065 6.89532 9.25184 9.9492 6.59517 numMergedOcc 0
42 mol 232 unq 0 iso 0 dist 5.29561 9.84479 11.4949 8.00949 8.56792 4.77491 numMergedOcc 0
43 mol 232 unq 1 iso 0 dist 5.29561 9.84479 11.4949 8.19257 5.75118 14.476 numMergedOcc 0
44 mol 232 unq 2 iso 0 dist 5.29561 9.82645 11.8349 8.00949 8.56792 17.8132 numMergedOcc 0
45 mol 232 unq 3 iso 0 dist 5.29561 9.82645 11.8349 8.19257 5.75118 9.96532 numMergedOcc 0
46 mol 232 unq 4 iso 0 dist 9.16638 9.84479 14.347 8.00949 14.7394 4.77491 numMergedOcc 0
47 mol 232 unq 5 iso 0 dist 9.16638 9.84479 14.347 8.19257 5.97529 14.476 numMergedOcc 0
48 mol 232 unq 6 iso 0 dist 9.16638 9.82645 9.07946 8.00949 14.7394 17.8132 numMergedOcc 0
49 mol 232 unq 7 iso 0 dist 9.16638 9.82645 9.07946 8.19257 5.97529 9.96532 numMergedOcc 0
50 mol 233 unq 0 iso 0 dist 7.74693 9.44671 11.8011 9.69772 9.30391 7.82473 numMergedOcc 0
51 mol 233 unq 1 iso 0 dist 7.74693 7.21531 5.89828 9.69772 9.30391 4.60977 numMergedOcc 0
52 mol 244 unq 0 iso 0 dist 5.06669 9.06357 5.11058 5.16859 3.62882 8.6028 numMergedOcc 0
53 mol 244 unq 1 iso 0 dist 5.06669 9.06357 5.11058 4.79207 7.8506 12.6842 numMergedOcc 0
54 mol 244 unq 2 iso 0 dist 5.65248 9.06357 10.8525 5.16859 5.2503 8.6028 numMergedOcc 0
55 mol 244 unq 3 iso 0 dist 5.65248 9.06357 10.8525 4.79207 3.66626 12.6842 numMergedOcc 0
56 mol 259 unq 0 iso 0 dist 5.30455 8.93518 4.95084 6.69951 9.58753 12.7942 numMergedOcc 0
57 mol 259 unq 1 iso 0 dist 6.8184 8.93518 6.85606 6.69951 6.78897 12.7942 numMergedOcc 0
58 mol 283 unq 0 iso 0 dist 8.36393 5.90728 4.01355 9.35302 15.5185 12.6455 numMergedOcc 0
59 mol 283 unq 1 iso 0 dist 8.36393 5.90728 4.01355 8.85163 6.35533 7.97597 numMergedOcc 0
60 mol 285 unq 0 iso 0 dist 8.12306 7.38536 8.7778 5.28731 10.1123 3.57803 numMergedOcc 0
61 mol 287 unq 0 iso 0 dist 9.39409 6.19545 12.2952 6.16127 11.7613 4.00861 numMergedOcc 0
62 mol 287 unq 1 iso 0 dist 9.39409 7.3388 8.37461 6.16127 11.7613 5.03775 numMergedOcc 0
63 mol 287 unq 2 iso 0 dist 9.39409 6.96248 4.03583 6.16127 11.7613 8.95194 numMergedOcc 0
64 mol 288 unq 0 iso 0 dist 9.39409 6.19545 12.2952 6.16127 11.7613 4.00861 numMergedOcc 0
65 mol 288 unq 1 iso 0 dist 9.39409 7.3388 8.37461 6.16127 11.7613 5.03775 numMergedOcc 0
66 mol 288 unq 2 iso 0 dist 9.39409 6.96248 4.03583 6.16127 11.7613 8.95194 numMergedOcc 0
67 mol 289 unq 0 iso 0 dist 9.39409 6.19545 12.2952 6.16127 11.7613 4.00861 numMergedOcc 0
68 mol 289 unq 1 iso 0 dist 9.39409 7.3388 8.37461 6.16127 11.7613 5.03775 numMergedOcc 0
69 mol 289 unq 2 iso 0 dist 9.39409 6.96248 4.03583 6.16127 11.7613 8.95194 numMergedOcc 0
70 mol 294 unq 0 iso 0 dist 8.89372 9.64435 10.7219 7.48987 11.5334 10.528 numMergedOcc 0
71 mol 294 unq 1 iso 0 dist 8.89372 9.64435 10.7219 8.35637 5.98695 4.83566 numMergedOcc 0
