0 mol 7 unq 0 iso 0 dist 7.10621 7.31201 10.789 13.8829 8.72114 13.6379 22.1274 16.4405 22.017 8.60435 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.10621 9.36807 10.515 13.8829 8.72114 9.97624 22.1274 16.4405 17.4118 8.60435 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.57077 8.47421 5.60154 9.5997 9.62394 9.57198 8.83269 11.0722 6.81435 8.076 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 8.57077 8.47421 5.60154 9.5997 9.62394 9.57198 15.5119 14.814 13.6861 6.32226 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 8.4674 6.20943 5.14627 4.64838 6.41575 5.82366 10.1882 5.18512 6.34272 6.39966 numMergedOcc 0
5 mol 19 unq 1 iso 0 dist 4.54938 8.78293 10.9543 4.97119 6.41575 13.1234 6.92532 5.18512 15.1136 6.39966 numMergedOcc 0
6 mol 19 unq 2 iso 0 dist 4.54938 8.23643 6.55187 4.97119 6.41575 11.3136 6.92532 5.18512 6.87842 6.39966 numMergedOcc 0
7 mol 19 unq 3 iso 0 dist 4.54938 7.82528 5.14627 4.97119 6.41575 5.82366 6.92532 5.18512 6.34272 6.39966 numMergedOcc 0
8 mol 19 unq 4 iso 0 dist 7.82074 8.73972 6.55187 6.01808 6.41575 11.3136 6.36455 5.18512 6.87842 6.39966 numMergedOcc 0
9 mol 19 unq 5 iso 0 dist 4.51865 6.20943 4.69858 4.64838 6.41423 5.82366 10.1882 9.47529 6.34272 6.39966 numMergedOcc 0
10 mol 19 unq 6 iso 0 dist 6.864 8.78293 11.4401 4.97119 6.41423 13.1234 6.92532 9.47529 15.1136 6.39966 numMergedOcc 0
11 mol 19 unq 7 iso 0 dist 6.864 8.23643 12.3093 4.97119 6.41423 11.3136 6.92532 9.47529 6.87842 6.39966 numMergedOcc 0
12 mol 19 unq 8 iso 0 dist 6.864 7.82528 4.69858 4.97119 6.41423 5.82366 6.92532 9.47529 6.34272 6.39966 numMergedOcc 0
13 mol 24 unq 0 iso 0 dist 6.86014 9.75144 5.39241 6.66749 9.41441 13.2857 11.1214 11.1124 13.5349 6.2004 numMergedOcc 0
14 mol 58 unq 0 iso 0 dist 6.86465 8.63333 6.47744 10.2049 8.80614 9.11258 14.62 10.4524 9.17656 6.62229 numMergedOcc 0
15 mol 58 unq 1 iso 0 dist 6.62496 9.64665 4.67832 9.95364 8.80614 10.4309 14.6584 10.4524 9.96449 6.62229 numMergedOcc 0
16 mol 58 unq 2 iso 0 dist 6.35756 8.89374 6.47744 5.49591 8.80614 9.11258 10.9864 10.4524 9.17656 6.62229 numMergedOcc 0
17 mol 73 unq 0 iso 0 dist 9.96396 8.70133 7.41074 5.11416 9.24757 7.10439 7.04044 8.26458 11.2505 6.48232 numMergedOcc 0
18 mol 73 unq 1 iso 0 dist 6.19304 4.65521 7.41074 6.56633 9.24757 7.10439 8.73253 8.26458 11.2505 6.48232 numMergedOcc 0
19 mol 75 unq 0 iso 0 dist 7.79912 5.15851 10.0425 11.4997 9.81166 13.1026 11.1537 5.36954 11.7476 7.6433 numMergedOcc 0
20 mol 85 unq 0 iso 0 dist 7.97049 9.47876 7.98917 9.29301 9.82915 10.0297 7.1589 6.37974 12.5072 8.70863 numMergedOcc 0
21 mol 85 unq 1 iso 0 dist 7.47541 7.22293 7.98917 13.5116 9.82915 10.0297 11.2808 6.37974 12.5072 8.70863 numMergedOcc 0
22 mol 119 unq 0 iso 0 dist 8.73993 9.63176 10.6679 7.20179 6.52773 11.8717 7.77116 3.78311 8.96522 8.8562 numMergedOcc 0
23 mol 119 unq 1 iso 0 dist 8.73993 9.63176 10.6679 9.89358 9.23858 15.8603 7.77116 3.78311 8.96522 7.91683 numMergedOcc 0
24 mol 119 unq 2 iso 0 dist 9.87172 9.38288 11.7228 10.9441 9.11344 17.5912 13.1741 4.99056 16.5148 8.8562 numMergedOcc 0
25 mol 119 unq 3 iso 0 dist 9.87172 6.19042 6.35763 10.9441 9.11344 11.1099 13.1741 4.99056 11.1324 8.8562 numMergedOcc 0
26 mol 119 unq 4 iso 0 dist 9.87172 7.44174 7.36192 10.9441 9.11344 11.8717 13.1741 4.99056 8.96522 8.8562 numMergedOcc 0
27 mol 119 unq 5 iso 0 dist 6.18601 9.80862 9.35964 10.4376 8.00003 16.6554 9.66471 5.75886 11.3071 7.12072 numMergedOcc 0
28 mol 119 unq 6 iso 0 dist 6.18601 8.43904 10.3457 10.4376 8.00003 16.109 9.66471 5.75886 11.2711 7.12072 numMergedOcc 0
29 mol 126 unq 0 iso 0 dist 6.06638 7.75534 7.01257 6.0268 6.30546 7.36017 9.46588 5.5703 5.83002 5.94233 numMergedOcc 0
30 mol 131 unq 0 iso 0 dist 7.12972 8.6243 6.19596 8.23791 9.90168 11.4282 8.71039 5.89022 8.15392 5.56627 numMergedOcc 0
31 mol 131 unq 1 iso 0 dist 7.12972 8.6243 6.19596 8.23791 9.90168 11.4282 6.92648 9.32969 6.01893 8.50562 numMergedOcc 0
32 mol 131 unq 2 iso 0 dist 6.85062 6.91348 6.19596 13.7237 9.90168 11.4282 11.6142 5.89022 8.15392 5.56627 numMergedOcc 0
33 mol 131 unq 3 iso 0 dist 6.85062 6.91348 6.19596 13.7237 9.90168 11.4282 9.29384 9.32969 6.01893 8.50562 numMergedOcc 0
34 mol 131 unq 4 iso 0 dist 6.85062 9.51418 6.6499 13.7237 9.90168 16.3398 11.6142 5.89022 11.6371 5.56627 numMergedOcc 0
35 mol 131 unq 5 iso 0 dist 6.85062 9.51418 6.6499 13.7237 9.90168 16.3398 9.29384 9.32969 15.1974 8.50562 numMergedOcc 0
36 mol 134 unq 0 iso 0 dist 6.54501 8.6355 10.1448 5.71679 7.69991 8.73604 13.846 13.1292 9.65798 9.30061 numMergedOcc 0
37 mol 134 unq 1 iso 0 dist 8.94367 8.79571 5.41704 4.57832 6.23142 8.73604 8.20836 9.4027 9.65798 9.30061 numMergedOcc 0
38 mol 134 unq 2 iso 0 dist 6.37586 5.42582 5.41704 5.29786 6.23142 8.73604 10.873 9.4027 9.65798 9.30061 numMergedOcc 0
39 mol 134 unq 3 iso 0 dist 6.49416 8.6355 5.41704 5.71679 6.23142 8.73604 13.846 9.4027 9.65798 9.30061 numMergedOcc 0
40 mol 134 unq 4 iso 0 dist 9.86662 8.79571 6.17103 4.57832 9.94764 8.73604 8.20836 5.12325 9.65798 9.30061 numMergedOcc 0
41 mol 134 unq 5 iso 0 dist 9.71307 5.42582 6.17103 5.29786 9.94764 8.73604 10.873 5.12325 9.65798 9.30061 numMergedOcc 0
42 mol 175 unq 0 iso 0 dist 6.57069 9.8589 7.5414 8.29015 9.77896 5.4997 12.6297 11.3554 5.95187 5.89564 numMergedOcc 0
43 mol 181 unq 0 iso 0 dist 5.98885 6.94688 5.86342 5.6044 9.72611 10.3766 6.51749 5.93488 10.4684 7.11785 numMergedOcc 0
44 mol 181 unq 1 iso 0 dist 5.98885 6.71012 9.14057 5.6044 9.72611 10.7723 6.51749 5.93488 12.69 7.11785 numMergedOcc 0
45 mol 204 unq 0 iso 0 dist 8.51516 5.90931 12.9483 5.86489 7.32294 11.641 6.85441 5.74707 10.7974 5.91727 numMergedOcc 0
46 mol 209 unq 0 iso 0 dist 7.56373 9.52027 6.43758 6.552 6.85935 12.3767 8.41195 4.90038 9.02883 7.97418 numMergedOcc 0
47 mol 220 unq 0 iso 0 dist 9.23153 6.84247 6.7067 7.11498 6.59716 9.7334 5.45036 6.17628 5.49803 5.37796 numMergedOcc 0
48 mol 220 unq 1 iso 0 dist 9.23153 6.99002 15.9568 7.11498 6.59716 13.5801 5.45036 6.17628 11.2241 5.37796 numMergedOcc 0
49 mol 222 unq 0 iso 0 dist 7.54212 7.18956 7.61682 13.3447 9.07471 16.4961 12.5287 6.42798 11.8794 9.08955 numMergedOcc 0
50 mol 239 unq 0 iso 0 dist 7.00034 7.20082 7.04058 10.0842 9.01021 10.9156 10.2163 5.66732 10.151 5.0804 numMergedOcc 0
