0 mol 19 unq 0 iso 0 dist 4.54938 7.20519 7.34551 6.92532 5.18512 12.3486 4.97119 6.41575 10.741 6.39966 7.75618 9.74255 4.96411 13.9675 9.95212 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 4.54938 6.864 5.80928 6.92532 5.18512 9.47529 4.97119 6.41575 6.41423 6.39966 7.75618 9.74255 7.08342 13.9675 9.95212 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 6.864 7.20519 7.07775 6.92532 9.47529 12.3486 4.97119 6.41423 10.741 6.39966 7.75618 7.08342 4.96411 13.9675 9.95212 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 6.864 4.54938 5.80928 6.92532 9.47529 5.18512 4.97119 6.41423 6.41575 6.39966 7.75618 7.08342 9.74255 13.9675 9.95212 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 6.86014 8.86116 10.0952 6.60423 6.00575 5.97304 4.32034 7.33768 12.9284 9.69752 9.41441 6.66749 14.012 11.9395 8.00171 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 6.86014 8.86116 10.0952 6.60423 6.00575 5.97304 8.67951 9.01567 13.4393 12.7806 9.41441 6.66749 14.012 11.9395 4.2121 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 6.86014 8.86116 10.0952 6.60423 6.00575 5.97304 8.52463 7.29868 8.60554 9.36461 9.41441 6.66749 14.012 11.9395 6.72323 numMergedOcc 0
7 mol 24 unq 3 iso 0 dist 8.86116 8.38394 6.44287 6.72502 6.58998 6.59374 14.012 9.41441 15.392 11.5841 12.9284 4.32034 10.1325 10.025 8.00171 numMergedOcc 0
8 mol 24 unq 4 iso 0 dist 8.86116 8.38394 6.44287 6.72502 6.58998 6.59374 14.012 9.41441 15.392 11.5841 17.592 12.2662 17.3058 13.0149 5.95834 numMergedOcc 0
9 mol 24 unq 5 iso 0 dist 8.86116 8.38394 6.44287 6.72502 6.58998 6.59374 14.012 9.41441 15.392 11.5841 13.4393 8.67951 13.6595 9.14963 4.2121 numMergedOcc 0
10 mol 24 unq 6 iso 0 dist 8.86116 8.38394 6.44287 6.72502 6.58998 6.59374 14.012 9.41441 15.392 11.5841 8.60554 8.52463 12.3994 6.99746 6.72323 numMergedOcc 0
11 mol 24 unq 7 iso 0 dist 8.86116 6.86014 10.0952 6.60423 5.97304 6.00575 8.52463 8.60554 7.29868 9.36461 9.41441 14.012 6.66749 11.9395 6.72323 numMergedOcc 0
12 mol 25 unq 0 iso 0 dist 7.57578 7.17969 4.33106 6.90155 9.36158 10.1525 6.08585 8.50222 7.55264 12.7162 6.16347 9.34396 10.8498 11.0508 6.25843 numMergedOcc 0
13 mol 25 unq 1 iso 0 dist 7.57578 7.17969 4.33106 6.90155 9.36158 10.1525 6.08585 8.50222 7.55264 12.7162 13.8469 10.5328 10.4337 18.98 8.88938 numMergedOcc 0
14 mol 25 unq 2 iso 0 dist 7.17969 7.57578 4.33106 6.90155 10.1525 9.36158 6.08585 7.55264 8.50222 12.7162 6.16347 10.8498 9.34396 11.0508 6.25843 numMergedOcc 0
15 mol 25 unq 3 iso 0 dist 7.17969 7.57578 4.33106 6.90155 10.1525 9.36158 6.08585 7.55264 8.50222 12.7162 13.8469 10.4337 10.5328 18.98 8.88938 numMergedOcc 0
16 mol 73 unq 0 iso 0 dist 9.96396 9.38498 15.7123 7.04044 8.26458 15.7304 5.11416 9.24757 13.8696 6.48232 12.1382 6.29906 20.1729 7.86177 8.87464 numMergedOcc 0
17 mol 73 unq 1 iso 0 dist 9.96396 9.75218 12.016 7.04044 8.26458 8.35241 5.11416 9.24757 13.0145 6.48232 12.1382 6.29906 14.8598 7.86177 8.87464 numMergedOcc 0
18 mol 85 unq 0 iso 0 dist 7.97049 6.19965 5.42586 7.1589 6.37974 5.08358 9.29301 9.82915 12.0078 8.70863 14.4725 10.4987 12.568 8.31077 9.66222 numMergedOcc 0
19 mol 98 unq 0 iso 0 dist 5.08437 6.48948 9.51923 7.26086 7.32662 13.4985 7.06961 6.7117 9.42961 8.43352 6.65501 4.4057 7.42446 11.2092 6.88901 numMergedOcc 0
20 mol 98 unq 1 iso 0 dist 5.08437 6.48948 9.51923 7.26086 7.32662 13.4985 7.06961 6.7117 9.42961 8.43352 11.3043 7.94178 15.7178 8.02554 7.36769 numMergedOcc 0
21 mol 98 unq 2 iso 0 dist 5.08437 6.10456 8.40073 7.26086 7.32662 6.934 7.06961 6.7117 4.47349 8.43352 6.65501 4.4057 9.67482 11.2092 6.88901 numMergedOcc 0
22 mol 98 unq 3 iso 0 dist 5.08437 6.10456 8.40073 7.26086 7.32662 6.934 7.06961 6.7117 4.47349 8.43352 11.3043 7.94178 9.85543 8.02554 7.36769 numMergedOcc 0
23 mol 98 unq 4 iso 0 dist 6.10456 5.08437 8.40073 7.26086 6.934 7.32662 7.06961 4.47349 6.7117 8.43352 6.65501 9.67482 4.4057 11.2092 6.88901 numMergedOcc 0
24 mol 98 unq 5 iso 0 dist 6.10456 5.08437 8.40073 7.26086 6.934 7.32662 7.06961 4.47349 6.7117 8.43352 11.3043 9.85543 7.94178 8.02554 7.36769 numMergedOcc 0
25 mol 98 unq 6 iso 0 dist 6.10456 6.48948 9.42358 7.26086 6.934 13.4985 7.06961 4.47349 9.42961 8.43352 6.65501 9.67482 7.42446 11.2092 6.88901 numMergedOcc 0
26 mol 98 unq 7 iso 0 dist 6.10456 6.48948 9.42358 7.26086 6.934 13.4985 7.06961 4.47349 9.42961 8.43352 11.3043 9.85543 15.7178 8.02554 7.36769 numMergedOcc 0
27 mol 100 unq 0 iso 0 dist 7.47343 6.45675 5.33144 9.00544 14.9392 11.8512 12.2861 8.30845 10.6086 20.8516 21.075 15.3454 17.331 28.9325 9.5057 numMergedOcc 0
28 mol 100 unq 1 iso 0 dist 7.47343 6.45675 5.33144 7.12017 12.6602 9.52882 12.2861 8.30845 10.6086 13.9603 21.075 15.3454 17.331 22.2825 9.5057 numMergedOcc 0
29 mol 100 unq 2 iso 0 dist 7.47343 8.86688 10.1407 9.00544 14.9392 9.01214 12.2861 8.30845 18.1777 20.8516 21.075 15.3454 25.2259 28.9325 9.5057 numMergedOcc 0
30 mol 100 unq 3 iso 0 dist 7.47343 8.86688 10.1407 7.12017 12.6602 14.8674 12.2861 8.30845 18.1777 13.9603 21.075 15.3454 25.2259 22.2825 9.5057 numMergedOcc 0
31 mol 134 unq 0 iso 0 dist 6.54501 6.49416 5.00526 5.53031 5.35679 8.46636 5.71679 7.69991 6.23142 10.0154 7.80532 7.41674 9.87376 8.98004 6.40575 numMergedOcc 0
32 mol 134 unq 1 iso 0 dist 8.94367 9.86662 6.81259 8.20836 9.4027 5.12325 4.57832 6.23142 9.94764 9.30061 10.5252 9.87376 14.9876 14.2253 6.40575 numMergedOcc 0
33 mol 134 unq 2 iso 0 dist 6.49416 6.54501 5.00526 5.53031 8.46636 5.35679 5.71679 6.23142 7.69991 10.0154 7.80532 9.87376 7.41674 8.98004 6.40575 numMergedOcc 0
34 mol 134 unq 3 iso 0 dist 9.86662 8.94367 6.81259 8.20836 5.12325 9.4027 4.57832 9.94764 6.23142 9.30061 10.5252 14.9876 9.87376 14.2253 6.40575 numMergedOcc 0
35 mol 181 unq 0 iso 0 dist 9.1374 5.98885 8.88798 6.51749 13.8722 5.93488 6.6251 6.2479 7.99195 10.8541 12.4878 4.43096 12.2164 17.0176 7.32087 numMergedOcc 0
36 mol 181 unq 1 iso 0 dist 9.1374 5.98885 8.88798 6.51749 13.8722 5.93488 6.6251 6.2479 7.99195 10.8541 10.6908 8.04639 5.77299 11.1881 8.86197 numMergedOcc 0
37 mol 181 unq 2 iso 0 dist 9.1374 9.15386 12.1628 6.51749 13.8722 7.64267 6.6251 6.2479 12.8533 10.8541 12.4878 4.43096 16.0596 17.0176 7.32087 numMergedOcc 0
38 mol 181 unq 3 iso 0 dist 9.1374 9.15386 12.1628 6.51749 13.8722 7.64267 6.6251 6.2479 12.8533 10.8541 10.6908 8.04639 8.85666 11.1881 8.86197 numMergedOcc 0
39 mol 181 unq 4 iso 0 dist 5.98885 9.1374 8.88798 6.51749 5.93488 13.8722 5.6044 9.72611 14.2254 7.11785 11.602 12.7358 19.8145 8.30281 7.22883 numMergedOcc 0
40 mol 181 unq 5 iso 0 dist 5.98885 9.1374 8.88798 6.51749 5.93488 13.8722 6.6251 7.99195 6.2479 10.8541 12.4878 12.2164 4.43096 17.0176 7.32087 numMergedOcc 0
41 mol 181 unq 6 iso 0 dist 5.98885 9.1374 8.88798 6.51749 5.93488 13.8722 6.6251 7.99195 6.2479 10.8541 10.6908 5.77299 8.04639 11.1881 8.86197 numMergedOcc 0
42 mol 181 unq 7 iso 0 dist 5.98885 9.15386 5.16002 6.51749 5.93488 7.64267 5.6044 9.72611 10.428 7.11785 11.602 12.7358 11.1467 8.30281 7.22883 numMergedOcc 0
43 mol 181 unq 8 iso 0 dist 5.98885 9.15386 5.16002 6.51749 5.93488 7.64267 6.6251 7.99195 12.8533 10.8541 12.4878 12.2164 16.0596 17.0176 7.32087 numMergedOcc 0
44 mol 181 unq 9 iso 0 dist 5.98885 9.15386 5.16002 6.51749 5.93488 7.64267 6.6251 7.99195 12.8533 10.8541 10.6908 5.77299 8.85666 11.1881 8.86197 numMergedOcc 0
45 mol 274 unq 0 iso 0 dist 7.56915 8.49997 6.33073 9.56685 5.90436 12.106 5.29529 8.52587 11.6126 8.2997 9.85289 6.20558 11.4459 5.36428 6.88827 numMergedOcc 0
46 mol 274 unq 1 iso 0 dist 7.56915 8.49997 6.33073 9.56685 5.90436 12.106 5.29529 8.52587 11.6126 8.2997 14.1515 16.3619 19.3878 14.986 9.16942 numMergedOcc 0
47 mol 274 unq 2 iso 0 dist 7.56915 8.49997 6.33073 8.49922 9.27829 12.9674 5.29529 8.52587 11.6126 10.4781 9.85289 6.20558 11.4459 11.9754 6.88827 numMergedOcc 0
48 mol 274 unq 3 iso 0 dist 7.56915 8.49997 6.33073 8.49922 9.27829 12.9674 5.29529 8.52587 11.6126 10.4781 14.1515 16.3619 19.3878 18.8429 9.16942 numMergedOcc 0
