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 4.94497 8.77457 11.4997 12.7056 7.35217 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 4.94497 8.77457 11.4997 12.7056 11.1833 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 4.94497 8.77457 11.4997 16.8602 7.35217 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 4.94497 8.77457 11.4997 16.8602 11.1833 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 8.50424 8.076 12.1193 6.0397 7.28672 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 12.9999 7.98679 13.8843 15.907 15.0583 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 12.9999 7.98679 13.8843 15.0129 15.0583 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 4.32034 9.69752 10.8435 5.90981 10.025 numMergedOcc 0
8 mol 24 unq 1 iso 0 dist 6.60423 7.95042 4.47891 5.39241 8.62284 11.8884 6.58998 9.38831 8.24948 11.3767 8.52463 9.36461 5.80953 13.719 6.99746 numMergedOcc 0
9 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 13.534 8.57827 15.5762 10.7055 12.6909 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 8.65802 9.33861 10.2518 12.3813 9.20197 18.6152 12.1157 8.03028 17.2727 4.35316 5.83515 7.94453 13.9486 6.91947 7.57205 numMergedOcc 0
11 mol 92 unq 2 iso 0 dist 8.65802 9.33861 10.2518 12.3813 9.20197 18.6152 7.23437 7.39754 11.7337 10.4552 13.534 8.57827 15.5762 10.7055 15.1698 numMergedOcc 0
12 mol 92 unq 3 iso 0 dist 8.65802 9.33861 10.2518 12.3813 9.20197 18.6152 7.23437 7.39754 11.7337 10.4552 5.83515 7.94453 13.9486 6.91947 6.82081 numMergedOcc 0
13 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 5.27847 6.51014 13.2829 12.7281 9.78297 numMergedOcc 0
14 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 5.27847 6.51014 13.2829 4.70993 9.78297 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 9.83476 7.2793 6.38897 13.1933 7.94153 11.0523 6.87725 8.12349 8.31881 7.0016 10.5063 4.5271 6.88127 4.35079 6.16503 numMergedOcc 0
16 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 14.4429 7.02575 12.6585 5.34643 9.6472 numMergedOcc 0
17 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 10.5063 4.5271 9.90692 4.35079 6.16503 numMergedOcc 0
18 mol 186 unq 3 iso 0 dist 9.83476 9.51091 8.93258 13.1933 7.94153 14.1797 6.87725 8.12349 11.7345 7.0016 14.4429 7.02575 15.5879 5.34643 9.6472 numMergedOcc 0
19 mol 186 unq 4 iso 0 dist 9.83476 7.85184 11.924 13.1933 7.94153 17.0388 6.87725 8.12349 12.1449 7.0016 10.5063 4.5271 14.7428 4.35079 6.16503 numMergedOcc 0
20 mol 186 unq 5 iso 0 dist 9.83476 7.85184 11.924 13.1933 7.94153 17.0388 6.87725 8.12349 12.1449 7.0016 14.4429 7.02575 15.7057 5.34643 9.6472 numMergedOcc 0
21 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 4.92618 8.3087 13.0402 5.89482 9.99277 numMergedOcc 0
22 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 4.92618 8.3087 13.0402 6.65167 9.99277 numMergedOcc 0
23 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 7.84019 8.3087 13.0402 5.89482 9.99277 numMergedOcc 0
24 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 7.84019 8.3087 13.0402 6.65167 9.99277 numMergedOcc 0
25 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 10.9043 8.3087 13.0402 5.89482 9.99277 numMergedOcc 0
26 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 10.9043 8.3087 13.0402 6.65167 9.99277 numMergedOcc 0
27 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 7.17211 8.20162 11.432 6.16433 6.59663 numMergedOcc 0
28 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 7.17211 8.20162 13.1625 6.16433 6.59663 numMergedOcc 0
29 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 7.17211 8.20162 10.351 6.16433 6.59663 numMergedOcc 0
30 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 6.26382 7.21655 11.9497 10.6815 11.5512 numMergedOcc 0
31 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 5.24812 7.21655 11.9497 10.6815 11.5512 numMergedOcc 0
