0 mol 8 unq 0 iso 0 dist 8.96553 9.62879 8.4069 7.43529 7.3915 10.6335 11.2076 8.79272 7.17012 7.12263 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 8.96553 9.62879 8.4069 7.43529 7.3915 10.6335 10.715 6.32152 12.9353 5.00267 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 4.54938 8.4674 7.67038 5.18512 6.92532 10.1882 11.6624 10.3648 11.8484 7.69625 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 4.54938 7.82074 5.03957 5.18512 6.92532 6.36455 11.6624 10.3648 6.49317 7.69625 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 7.82074 8.4674 10.3915 5.18512 6.36455 10.1882 11.6624 6.49317 11.8484 7.69625 numMergedOcc 0
5 mol 19 unq 3 iso 0 dist 7.82074 4.54938 5.03957 5.18512 6.36455 6.92532 11.6624 6.49317 10.3648 7.69625 numMergedOcc 0
6 mol 19 unq 4 iso 0 dist 6.864 4.51865 7.67038 9.47529 6.92532 10.1882 13.8921 10.3648 11.8484 7.69625 numMergedOcc 0
7 mol 24 unq 0 iso 0 dist 8.86116 8.38394 6.44287 5.97304 6.60423 9.0934 6.72502 6.58998 6.59374 9.38831 numMergedOcc 0
8 mol 24 unq 1 iso 0 dist 8.86116 6.86014 10.0952 6.58998 6.72502 10.7114 13.0257 11.2106 12.0003 9.40479 numMergedOcc 0
9 mol 24 unq 2 iso 0 dist 8.86116 6.86014 10.0952 6.58998 6.72502 10.7114 6.60423 5.97304 6.00575 9.38831 numMergedOcc 0
10 mol 24 unq 3 iso 0 dist 5.54419 7.36323 12.3067 4.33963 4.93188 9.24958 11.2485 9.48345 13.1456 9.40479 numMergedOcc 0
11 mol 24 unq 4 iso 0 dist 5.54419 7.36323 12.3067 4.33963 4.93188 9.24958 11.9933 14.4162 10.0655 9.58012 numMergedOcc 0
12 mol 24 unq 5 iso 0 dist 7.36323 5.54419 12.3067 4.33963 9.24958 4.93188 11.2485 13.1456 9.48345 9.40479 numMergedOcc 0
13 mol 24 unq 6 iso 0 dist 7.36323 5.54419 12.3067 4.33963 9.24958 4.93188 11.9933 10.0655 14.4162 9.58012 numMergedOcc 0
14 mol 43 unq 0 iso 0 dist 5.73819 6.20293 5.06502 5.48048 8.44903 10.0649 8.60739 5.64171 9.06158 7.31982 numMergedOcc 0
15 mol 43 unq 1 iso 0 dist 5.73819 8.93915 5.89973 5.48048 8.44903 13.5072 8.60739 5.64171 11.3891 7.31982 numMergedOcc 0
16 mol 43 unq 2 iso 0 dist 8.80331 6.20293 8.13395 9.06158 9.93832 8.60739 10.0649 7.05402 5.48048 7.31982 numMergedOcc 0
17 mol 43 unq 3 iso 0 dist 6.20293 8.80331 8.13395 9.06158 8.60739 9.93832 10.0649 5.48048 7.05402 7.31982 numMergedOcc 0
18 mol 112 unq 0 iso 0 dist 9.60462 7.45389 7.05226 3.98564 7.23962 7.30204 13.2485 6.89221 9.96887 9.74569 numMergedOcc 0
19 mol 112 unq 1 iso 0 dist 7.45389 9.60462 7.05226 3.98564 7.30204 7.23962 13.2485 9.96887 6.89221 9.74569 numMergedOcc 0
20 mol 115 unq 0 iso 0 dist 5.83991 9.33865 7.69052 6.4497 5.72642 10.9734 10.9766 7.21418 6.08806 8.71286 numMergedOcc 0
21 mol 115 unq 1 iso 0 dist 6.11741 9.33865 8.02349 6.08806 5.74857 10.9766 10.9734 7.3094 6.4497 8.71286 numMergedOcc 0
22 mol 115 unq 2 iso 0 dist 7.88312 7.30858 11.5723 7.21418 5.74857 10.0289 5.72642 7.3094 5.61704 8.71286 numMergedOcc 0
23 mol 115 unq 3 iso 0 dist 7.88312 5.83991 8.02349 7.21418 5.74857 10.9766 5.72642 7.3094 6.4497 8.71286 numMergedOcc 0
24 mol 115 unq 4 iso 0 dist 7.88312 6.11741 7.69052 7.3094 5.72642 10.9734 5.74857 7.21418 6.08806 8.71286 numMergedOcc 0
25 mol 131 unq 0 iso 0 dist 7.12972 8.40312 5.55373 9.32969 6.92648 11.4206 16.4092 11.5688 15.0243 7.76594 numMergedOcc 0
26 mol 131 unq 1 iso 0 dist 7.12972 6.85062 6.63273 9.32969 6.92648 9.29384 16.4092 11.5688 15.7796 7.76594 numMergedOcc 0
27 mol 131 unq 2 iso 0 dist 6.85062 8.40312 10.7062 9.32969 9.29384 11.4206 16.4092 15.7796 15.0243 7.76594 numMergedOcc 0
28 mol 131 unq 3 iso 0 dist 6.85062 7.12972 6.63273 9.32969 9.29384 6.92648 16.4092 15.7796 11.5688 7.76594 numMergedOcc 0
29 mol 152 unq 0 iso 0 dist 5.87555 6.70283 5.42328 5.59336 8.35555 10.4911 9.39331 7.78913 12.9816 8.60521 numMergedOcc 0
30 mol 152 unq 1 iso 0 dist 5.87555 6.70283 5.42328 5.59336 8.35555 10.4911 8.28642 5.70788 9.35627 6.39031 numMergedOcc 0
31 mol 152 unq 2 iso 0 dist 5.87555 8.67331 5.54906 5.59336 8.35555 13.0858 9.39331 7.78913 11.2503 8.60521 numMergedOcc 0
32 mol 152 unq 3 iso 0 dist 5.87555 8.67331 5.54906 5.59336 8.35555 13.0858 8.28642 5.70788 11.2078 6.39031 numMergedOcc 0
33 mol 152 unq 4 iso 0 dist 5.87555 8.87437 5.49936 5.70788 8.28642 13.1536 8.35555 5.59336 10.9728 6.39031 numMergedOcc 0
34 mol 152 unq 5 iso 0 dist 8.87437 7.16148 5.42328 10.9728 8.35555 10.4911 13.5822 7.78913 12.9816 8.60521 numMergedOcc 0
35 mol 152 unq 6 iso 0 dist 8.87437 7.16148 5.42328 10.9728 8.35555 10.4911 13.1536 5.70788 9.35627 6.39031 numMergedOcc 0
36 mol 152 unq 7 iso 0 dist 8.87437 8.05741 5.54906 10.9728 8.35555 13.0858 13.5822 7.78913 11.2503 8.60521 numMergedOcc 0
37 mol 152 unq 8 iso 0 dist 8.87437 8.05741 5.54906 10.9728 8.35555 13.0858 13.1536 5.70788 11.2078 6.39031 numMergedOcc 0
38 mol 152 unq 9 iso 0 dist 8.56324 6.70283 7.65448 9.35627 9.77552 8.28642 10.4911 7.2238 5.59336 6.39031 numMergedOcc 0
39 mol 152 unq 10 iso 0 dist 8.56324 7.16148 10.6875 9.35627 9.77552 13.1536 10.4911 7.2238 10.9728 6.39031 numMergedOcc 0
40 mol 152 unq 11 iso 0 dist 6.70283 8.56324 7.65448 9.35627 8.28642 9.77552 10.4911 5.59336 7.2238 6.39031 numMergedOcc 0
41 mol 152 unq 12 iso 0 dist 6.70283 7.16148 5.49936 9.35627 8.28642 13.1536 10.4911 5.59336 10.9728 6.39031 numMergedOcc 0
42 mol 152 unq 13 iso 0 dist 8.67331 8.05741 5.49936 11.2078 8.28642 13.1536 13.0858 5.59336 10.9728 6.39031 numMergedOcc 0
43 mol 156 unq 0 iso 0 dist 8.34702 9.06726 6.31306 6.44255 9.43259 11.1392 5.38091 10.7023 9.00862 5.90883 numMergedOcc 0
44 mol 156 unq 1 iso 0 dist 8.34702 9.06726 6.31306 5.82636 6.2319 9.97732 7.73169 5.71107 11.2067 4.9941 numMergedOcc 0
45 mol 156 unq 2 iso 0 dist 8.34702 9.06726 6.31306 5.82636 6.2319 9.97732 5.38091 10.7023 9.00862 8.06913 numMergedOcc 0
46 mol 156 unq 3 iso 0 dist 8.34702 8.33171 6.56229 6.44255 9.43259 12.8935 5.38091 10.7023 11.1271 5.90883 numMergedOcc 0
47 mol 156 unq 4 iso 0 dist 8.34702 8.33171 6.56229 5.82636 6.2319 10.5243 7.73169 5.71107 9.44399 4.9941 numMergedOcc 0
48 mol 156 unq 5 iso 0 dist 8.34702 8.33171 6.56229 5.82636 6.2319 10.5243 5.38091 10.7023 11.1271 8.06913 numMergedOcc 0
49 mol 156 unq 6 iso 0 dist 9.06726 8.34702 6.31306 5.82636 9.97732 6.2319 7.73169 11.2067 5.71107 4.9941 numMergedOcc 0
50 mol 156 unq 7 iso 0 dist 9.06726 8.34702 6.31306 5.82636 9.97732 6.2319 5.38091 9.00862 10.7023 8.06913 numMergedOcc 0
51 mol 156 unq 8 iso 0 dist 9.06726 8.33171 5.64555 5.82636 9.97732 10.5243 7.73169 11.2067 9.44399 4.9941 numMergedOcc 0
52 mol 156 unq 9 iso 0 dist 9.06726 8.33171 5.64555 5.82636 9.97732 10.5243 5.38091 9.00862 11.1271 8.06913 numMergedOcc 0
53 mol 186 unq 0 iso 0 dist 7.54065 9.70748 13.8792 8.90184 7.20574 18.0414 15.9107 12.7155 24.2168 7.55358 numMergedOcc 0
54 mol 186 unq 1 iso 0 dist 7.54065 9.70748 13.8792 8.90184 7.20574 18.0414 15.8402 11.2142 22.8279 8.87818 numMergedOcc 0
55 mol 186 unq 2 iso 0 dist 7.54065 8.87694 5.74635 8.90184 7.20574 6.85302 15.9107 12.7155 9.97575 7.55358 numMergedOcc 0
56 mol 186 unq 3 iso 0 dist 7.54065 8.87694 5.74635 8.90184 7.20574 6.85302 15.8402 11.2142 7.92653 8.87818 numMergedOcc 0
57 mol 186 unq 4 iso 0 dist 8.87694 9.70748 14.9058 8.90184 6.85302 18.0414 15.9107 9.97575 24.2168 7.55358 numMergedOcc 0
58 mol 186 unq 5 iso 0 dist 8.87694 9.70748 14.9058 8.90184 6.85302 18.0414 15.8402 7.92653 22.8279 8.87818 numMergedOcc 0
59 mol 186 unq 6 iso 0 dist 8.87694 9.70748 14.9058 12.8303 9.98215 20.9635 15.9107 9.97575 24.2168 7.60991 numMergedOcc 0
60 mol 186 unq 7 iso 0 dist 8.87694 7.54065 5.74635 8.90184 6.85302 7.20574 15.9107 9.97575 12.7155 7.55358 numMergedOcc 0
61 mol 186 unq 8 iso 0 dist 8.87694 7.54065 5.74635 8.90184 6.85302 7.20574 15.8402 7.92653 11.2142 8.87818 numMergedOcc 0
62 mol 186 unq 9 iso 0 dist 8.87694 7.54065 5.74635 12.8303 9.98215 13.6209 15.9107 9.97575 12.7155 7.60991 numMergedOcc 0
63 mol 186 unq 10 iso 0 dist 9.09754 8.87694 9.50685 9.97575 8.64409 15.9107 6.85302 4.37002 8.90184 7.55358 numMergedOcc 0
64 mol 186 unq 11 iso 0 dist 9.09754 8.87694 9.50685 9.97575 8.64409 15.9107 9.98215 4.64235 12.8303 7.60991 numMergedOcc 0
65 mol 227 unq 0 iso 0 dist 7.22101 7.09863 4.39704 10.5813 8.03442 12.2278 8.38865 11.0628 12.9587 9.56257 numMergedOcc 0
66 mol 227 unq 1 iso 0 dist 7.22101 9.34734 6.99063 11.0628 8.38865 12.9778 8.03442 10.5813 10.2525 9.56257 numMergedOcc 0
67 mol 227 unq 2 iso 0 dist 7.22101 8.65997 5.22356 11.0628 8.38865 5.4694 8.03442 10.5813 7.22396 9.56257 numMergedOcc 0
68 mol 227 unq 3 iso 0 dist 7.22101 7.56888 10.8658 11.0628 8.38865 13.9676 8.03442 10.5813 6.10296 9.56257 numMergedOcc 0
69 mol 227 unq 4 iso 0 dist 7.22101 7.55216 12.4689 11.0628 8.38865 16.9219 8.03442 10.5813 9.69537 9.56257 numMergedOcc 0
70 mol 227 unq 5 iso 0 dist 8.65997 9.34734 7.60506 11.0628 5.4694 12.9778 8.03442 7.22396 10.2525 9.56257 numMergedOcc 0
71 mol 227 unq 6 iso 0 dist 8.65997 7.22101 5.22356 11.0628 5.4694 8.38865 8.03442 7.22396 10.5813 9.56257 numMergedOcc 0
72 mol 227 unq 7 iso 0 dist 8.65997 7.56888 9.70012 11.0628 5.4694 13.9676 8.03442 7.22396 6.10296 9.56257 numMergedOcc 0
73 mol 227 unq 8 iso 0 dist 8.65997 7.55216 12.9332 11.0628 5.4694 16.9219 8.03442 7.22396 9.69537 9.56257 numMergedOcc 0
74 mol 252 unq 0 iso 0 dist 8.1148 8.33025 6.0987 11.056 6.53679 7.50201 12.322 6.28227 5.25252 8.55481 numMergedOcc 0
75 mol 252 unq 1 iso 0 dist 8.1715 9.2288 6.0987 5.23748 6.53679 7.50201 12.2615 6.28227 5.25252 8.55481 numMergedOcc 0
76 mol 252 unq 2 iso 0 dist 8.33025 8.1148 6.0987 11.056 7.50201 6.53679 12.322 5.25252 6.28227 8.55481 numMergedOcc 0
77 mol 252 unq 3 iso 0 dist 9.2288 8.1715 6.0987 5.23748 7.50201 6.53679 12.2615 5.25252 6.28227 8.55481 numMergedOcc 0
78 mol 252 unq 4 iso 0 dist 7.19638 8.33025 14.9102 5.25252 6.86945 12.322 7.50201 7.63376 11.056 8.55481 numMergedOcc 0
79 mol 252 unq 5 iso 0 dist 7.19638 9.2288 11.7918 5.25252 6.86945 12.2615 7.50201 7.63376 5.23748 8.55481 numMergedOcc 0
80 mol 258 unq 0 iso 0 dist 6.60405 6.42289 7.26417 7.42673 6.70815 7.99477 9.53063 6.6525 5.27959 6.47194 numMergedOcc 0
81 mol 258 unq 1 iso 0 dist 6.42289 6.60405 7.26417 7.42673 7.99477 6.70815 9.53063 5.27959 6.6525 6.47194 numMergedOcc 0
