0 mol 8 unq 0 iso 0 dist 6.82379 6.56356 8.64248 13.7792 8.94096 17.0548 5.7531 7.12263 8.83742 14.5611 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 6.82379 6.56356 8.64248 13.7792 8.94096 17.0548 11.0223 5.00267 13.4523 6.69972 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 6.82379 6.56356 8.64248 15.4959 9.07858 15.5373 5.7531 7.12263 8.83742 12.9762 numMergedOcc 0
3 mol 8 unq 3 iso 0 dist 6.82379 6.56356 8.64248 15.4959 9.07858 15.5373 11.0223 5.00267 13.4523 6.3125 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 7.05346 8.30653 4.3947 13.5628 9.82483 13.9961 6.119 5.55437 8.71372 10.4204 numMergedOcc 0
5 mol 13 unq 0 iso 0 dist 8.43325 9.45635 9.75022 8.66829 8.00865 10.3157 7.82977 9.10587 15.0652 7.65383 numMergedOcc 0
6 mol 13 unq 1 iso 0 dist 8.43325 9.45635 9.75022 14.2112 9.11447 17.3812 7.82977 9.10587 15.0652 8.58799 numMergedOcc 0
7 mol 24 unq 0 iso 0 dist 6.60423 7.95042 4.47891 5.39241 8.62284 11.8884 6.58998 9.38831 8.24948 11.3767 numMergedOcc 0
8 mol 56 unq 0 iso 0 dist 8.63486 9.2898 15.8558 11.2318 8.98797 13.5478 12.8132 6.91393 18.0548 5.73443 numMergedOcc 0
9 mol 56 unq 1 iso 0 dist 8.63486 9.2898 15.8558 11.2318 8.98797 13.5478 16.7219 8.40038 22.5119 11.075 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 8.65802 9.33861 10.2518 12.3813 9.20197 18.6152 12.1157 8.03028 17.2727 4.35316 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 8.65802 9.33861 10.2518 12.3813 9.20197 18.6152 7.23437 7.39754 11.7337 10.4552 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 5.72642 7.69765 7.27912 11.7126 9.9928 16.7897 7.21418 8.71286 14.0614 6.03931 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 5.72642 9.42082 10.5109 11.7126 9.9928 12.9982 7.21418 8.71286 10.3973 6.03931 numMergedOcc 0
14 mol 119 unq 0 iso 0 dist 7.99857 6.99446 6.29394 6.35763 9.87025 6.13374 4.99056 8.03035 9.57341 11.1324 numMergedOcc 0
15 mol 119 unq 1 iso 0 dist 7.99857 6.99446 6.29394 7.36192 5.85818 9.08536 4.99056 8.03035 9.57341 8.96522 numMergedOcc 0
16 mol 119 unq 2 iso 0 dist 8.56342 7.64052 6.29394 10.0197 9.87025 6.13374 3.78311 8.03035 9.57341 11.1324 numMergedOcc 0
17 mol 119 unq 3 iso 0 dist 8.56342 7.64052 6.29394 10.6679 5.85818 9.08536 3.78311 8.03035 9.57341 8.96522 numMergedOcc 0
18 mol 143 unq 0 iso 0 dist 8.41611 7.36975 9.05786 5.44503 6.40901 8.18023 10.8441 5.73236 13.5717 7.12863 numMergedOcc 0
19 mol 143 unq 1 iso 0 dist 8.41611 5.40637 6.16103 5.44503 6.40901 7.46803 10.8441 5.73236 8.68663 7.12863 numMergedOcc 0
20 mol 154 unq 0 iso 0 dist 7.72144 8.33439 14.4682 13.9336 9.47362 17.5983 11.0347 9.71408 14.6089 5.63464 numMergedOcc 0
21 mol 154 unq 1 iso 0 dist 7.72144 8.33439 14.4682 6.53652 6.28417 14.6576 11.0347 9.71408 14.6089 13.5582 numMergedOcc 0
22 mol 184 unq 0 iso 0 dist 8.77887 9.90822 6.88536 6.47974 6.21206 10.9394 5.16512 9.05835 13.1226 4.05428 numMergedOcc 0
23 mol 184 unq 1 iso 0 dist 8.77887 6.73504 6.19242 6.47974 6.21206 7.59939 5.16512 9.05835 7.32888 4.05428 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 6.72641 7.05695 8.1007 10.5203 9.59034 12.8056 8.12143 7.23293 13.538 8.37278 numMergedOcc 0
25 mol 186 unq 1 iso 0 dist 9.83476 7.2793 6.38897 13.1933 7.94153 11.0523 6.87725 8.12349 8.31881 7.0016 numMergedOcc 0
26 mol 186 unq 2 iso 0 dist 9.83476 9.51091 8.93258 13.1933 7.94153 14.1797 6.87725 8.12349 11.7345 7.0016 numMergedOcc 0
27 mol 186 unq 3 iso 0 dist 9.83476 7.85184 11.924 13.1933 7.94153 17.0388 6.87725 8.12349 12.1449 7.0016 numMergedOcc 0
28 mol 218 unq 0 iso 0 dist 6.29367 8.75536 6.57708 6.05563 6.86795 11.2108 6.90702 8.93185 9.11192 6.08698 numMergedOcc 0
29 mol 218 unq 1 iso 0 dist 6.29367 8.75536 6.57708 8.36122 6.61099 12.5343 6.90702 8.93185 9.11192 13.6339 numMergedOcc 0
30 mol 218 unq 2 iso 0 dist 5.76954 7.33709 6.57708 9.68444 6.86795 11.2108 10.4526 8.93185 9.11192 6.08698 numMergedOcc 0
31 mol 218 unq 3 iso 0 dist 5.76954 7.33709 6.57708 7.47048 6.61099 12.5343 10.4526 8.93185 9.11192 13.6339 numMergedOcc 0
32 mol 218 unq 4 iso 0 dist 9.20961 6.67404 6.57708 11.4148 6.86795 11.2108 8.94041 8.93185 9.11192 6.08698 numMergedOcc 0
33 mol 218 unq 5 iso 0 dist 9.20961 6.67404 6.57708 12.7963 6.61099 12.5343 8.94041 8.93185 9.11192 13.6339 numMergedOcc 0
34 mol 225 unq 0 iso 0 dist 6.6561 6.50998 6.35462 8.69249 5.13453 8.91356 4.76151 6.53728 9.87668 8.99405 numMergedOcc 0
35 mol 225 unq 1 iso 0 dist 6.6561 9.09424 5.94765 8.69249 5.13453 11.0655 4.76151 6.53728 8.42121 8.99405 numMergedOcc 0
36 mol 225 unq 2 iso 0 dist 6.6561 8.14831 11.2847 8.69249 5.13453 13.9144 4.76151 6.53728 4.98402 8.99405 numMergedOcc 0
37 mol 227 unq 0 iso 0 dist 8.38865 5.23634 7.3164 9.60993 9.20589 12.2075 10.5813 9.56257 9.43618 8.84427 numMergedOcc 0
38 mol 227 unq 1 iso 0 dist 8.38865 5.23634 7.3164 13.3557 7.89801 11.5426 10.5813 9.56257 9.43618 5.95112 numMergedOcc 0
39 mol 227 unq 2 iso 0 dist 5.4694 6.91318 7.3164 5.34702 9.20589 12.2075 7.22396 9.56257 9.43618 8.84427 numMergedOcc 0
40 mol 227 unq 3 iso 0 dist 5.4694 6.91318 7.3164 8.8709 7.89801 11.5426 7.22396 9.56257 9.43618 5.95112 numMergedOcc 0
41 mol 238 unq 0 iso 0 dist 6.4398 8.82351 6.22195 15.3074 9.42618 13.8196 5.87253 9.89583 11.2897 18.0054 numMergedOcc 0
42 mol 238 unq 1 iso 0 dist 7.32982 9.72188 13.0611 8.85181 9.42618 18.3572 10.7551 9.89583 6.53286 18.0054 numMergedOcc 0
43 mol 238 unq 2 iso 0 dist 5.52379 9.07475 6.50998 11.6239 7.61203 11.316 14.1055 9.89583 14.5645 10.6355 numMergedOcc 0
44 mol 238 unq 3 iso 0 dist 5.52379 9.07475 6.50998 13.9614 9.47845 14.1582 14.1055 9.89583 14.5645 6.48619 numMergedOcc 0
45 mol 238 unq 4 iso 0 dist 5.52379 9.07475 6.50998 12.3042 6.92409 10.2916 14.1055 9.89583 14.5645 5.8333 numMergedOcc 0
46 mol 238 unq 5 iso 0 dist 5.52379 9.07475 6.50998 5.54325 6.89694 8.82776 14.1055 9.89583 14.5645 16.1577 numMergedOcc 0
47 mol 238 unq 6 iso 0 dist 5.52379 6.99888 5.63944 11.6239 7.61203 9.99105 14.1055 9.89583 15.0962 10.6355 numMergedOcc 0
48 mol 238 unq 7 iso 0 dist 5.52379 6.99888 5.63944 13.9614 9.47845 13.7042 14.1055 9.89583 15.0962 6.48619 numMergedOcc 0
49 mol 238 unq 8 iso 0 dist 5.52379 6.99888 5.63944 12.3042 6.92409 10.8123 14.1055 9.89583 15.0962 5.8333 numMergedOcc 0
50 mol 238 unq 9 iso 0 dist 5.52379 6.99888 5.63944 5.54325 6.89694 5.43613 14.1055 9.89583 15.0962 16.1577 numMergedOcc 0
51 mol 264 unq 0 iso 0 dist 6.04162 9.19754 5.82131 8.16326 9.42738 13.8261 6.84156 5.74568 6.02757 8.79843 numMergedOcc 0
52 mol 264 unq 1 iso 0 dist 6.14323 8.29262 5.82131 12.3807 9.42738 13.8261 9.37297 5.74568 6.02757 8.79843 numMergedOcc 0
