0 mol 8 unq 0 iso 0 dist 8.96553 7.3915 7.43529 8.79272 11.2076 7.12263 8.53529 4.36226 5.65816 7.27018 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 8.57077 9.78006 3.98483 11.0722 8.83269 5.55437 9.62394 9.5997 7.28672 8.076 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.86116 6.72502 6.58998 11.2106 13.0257 9.40479 8.60554 8.52463 6.99746 4.90592 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.86116 6.72502 6.58998 11.2106 13.0257 9.40479 9.44691 13.4893 7.05541 8.16324 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 8.86116 6.72502 6.58998 5.97304 6.60423 9.38831 12.9284 4.32034 10.025 9.69752 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 8.86116 6.72502 6.58998 5.97304 6.60423 9.38831 8.60554 8.52463 6.99746 9.36461 numMergedOcc 0
6 mol 24 unq 4 iso 0 dist 8.38394 6.72502 6.59374 11.2106 15.7639 9.40479 8.60554 12.3994 6.99746 4.90592 numMergedOcc 0
7 mol 24 unq 5 iso 0 dist 8.38394 6.72502 6.59374 11.2106 15.7639 9.40479 9.44691 12.505 7.05541 8.16324 numMergedOcc 0
8 mol 24 unq 6 iso 0 dist 8.38394 6.72502 6.59374 5.97304 9.0934 9.38831 12.9284 10.1325 10.025 9.69752 numMergedOcc 0
9 mol 24 unq 7 iso 0 dist 8.38394 6.72502 6.59374 5.97304 9.0934 9.38831 8.60554 12.3994 6.99746 9.36461 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 7.30858 5.72642 5.61704 7.21418 10.0289 8.71286 12.13 13.2157 9.18958 8.85881 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 5.83991 5.72642 6.4497 7.21418 10.9766 8.71286 12.13 11.8511 9.18958 8.85881 numMergedOcc 0
12 mol 115 unq 2 iso 0 dist 7.88312 5.72642 7.3094 7.21418 5.74857 8.71286 12.13 5.22052 9.18958 8.85881 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 8.73993 8.56342 4.91132 3.78311 7.77116 8.03035 6.52773 7.20179 6.96805 8.8562 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 8.73993 8.56342 4.91132 3.78311 7.77116 8.03035 9.23858 9.89358 13.3975 7.91683 numMergedOcc 0
15 mol 119 unq 2 iso 0 dist 8.73993 6.37542 6.08167 3.78311 7.77116 7.6968 6.52773 7.20179 4.86811 8.8562 numMergedOcc 0
16 mol 119 unq 3 iso 0 dist 8.73993 6.37542 6.08167 3.78311 7.77116 7.6968 9.23858 9.89358 8.00229 7.91683 numMergedOcc 0
17 mol 119 unq 4 iso 0 dist 9.87172 7.99857 7.61939 4.99056 13.1741 8.03035 9.11344 10.9441 6.96805 8.8562 numMergedOcc 0
18 mol 119 unq 5 iso 0 dist 9.87172 7.99857 7.61939 4.99056 13.1741 8.03035 12.7677 20.1288 13.3975 7.91683 numMergedOcc 0
19 mol 131 unq 0 iso 0 dist 7.12972 6.92648 9.32969 11.5688 16.4092 7.76594 11.8964 14.3406 5.66194 5.39061 numMergedOcc 0
20 mol 131 unq 1 iso 0 dist 6.85062 9.29384 9.32969 15.7796 16.4092 7.76594 14.9021 14.3406 5.66194 5.39061 numMergedOcc 0
21 mol 143 unq 0 iso 0 dist 5.99315 8.41611 12.7056 10.8441 13.4668 5.73236 9.14266 10.4028 5.99865 6.95372 numMergedOcc 0
22 mol 152 unq 0 iso 0 dist 5.87555 8.35555 5.59336 7.78913 9.39331 8.60521 11.3523 10.4297 7.72754 5.06613 numMergedOcc 0
23 mol 152 unq 1 iso 0 dist 8.87437 8.35555 10.9728 7.78913 13.5822 8.60521 11.3523 15.0695 7.72754 5.06613 numMergedOcc 0
24 mol 156 unq 0 iso 0 dist 8.34702 9.43259 6.44255 10.7023 5.38091 5.90883 13.0658 5.81563 11.3995 7.46845 numMergedOcc 0
25 mol 156 unq 1 iso 0 dist 8.34702 6.2319 5.82636 10.7023 5.38091 8.06913 13.0658 5.81563 11.6326 7.46845 numMergedOcc 0
26 mol 156 unq 2 iso 0 dist 9.06726 9.97732 5.82636 9.00862 5.38091 8.06913 11.5017 5.81563 11.6326 7.46845 numMergedOcc 0
27 mol 175 unq 0 iso 0 dist 9.29945 5.4969 12.3408 4.24624 8.0154 7.32419 10.7017 6.29885 11.2348 8.05247 numMergedOcc 0
28 mol 175 unq 1 iso 0 dist 9.29945 5.4969 12.3408 4.24624 8.0154 7.32419 9.39352 7.27408 8.94702 9.71028 numMergedOcc 0
29 mol 175 unq 2 iso 0 dist 9.29945 6.4318 8.68081 4.24624 8.0154 8.31961 10.7017 6.29885 9.23758 8.05247 numMergedOcc 0
30 mol 175 unq 3 iso 0 dist 9.29945 6.4318 8.68081 4.24624 8.0154 8.31961 9.39352 7.27408 4.06277 9.71028 numMergedOcc 0
31 mol 186 unq 0 iso 0 dist 7.54065 7.20574 8.90184 12.7155 15.9107 7.55358 19.5202 20.8288 13.1254 7.46987 numMergedOcc 0
32 mol 186 unq 1 iso 0 dist 8.87694 6.85302 8.90184 9.97575 15.9107 7.55358 16.2017 20.8288 13.1254 7.46987 numMergedOcc 0
33 mol 186 unq 2 iso 0 dist 8.87694 9.98215 12.8303 9.97575 15.9107 7.60991 16.2017 20.8288 8.74186 7.46987 numMergedOcc 0
34 mol 186 unq 3 iso 0 dist 9.09754 6.85302 4.37002 9.97575 8.64409 7.55358 16.2017 11.6919 13.1254 7.46987 numMergedOcc 0
35 mol 186 unq 4 iso 0 dist 9.09754 9.98215 4.64235 9.97575 8.64409 7.60991 16.2017 11.6919 8.74186 7.46987 numMergedOcc 0
36 mol 252 unq 0 iso 0 dist 8.1148 6.53679 11.056 6.28227 12.322 8.55481 12.9597 19.1145 12.0545 7.39391 numMergedOcc 0
37 mol 252 unq 1 iso 0 dist 8.1715 6.53679 5.23748 6.28227 12.2615 8.55481 12.9597 16.9237 12.0545 7.39391 numMergedOcc 0
38 mol 252 unq 2 iso 0 dist 8.33025 7.50201 11.056 5.25252 12.322 8.55481 11.0831 19.1145 12.0545 7.39391 numMergedOcc 0
39 mol 252 unq 3 iso 0 dist 9.2288 7.50201 5.23748 5.25252 12.2615 8.55481 11.0831 16.9237 12.0545 7.39391 numMergedOcc 0
40 mol 252 unq 4 iso 0 dist 7.19638 7.50201 7.63376 5.25252 6.86945 8.55481 11.0831 6.35641 12.0545 7.39391 numMergedOcc 0
41 mol 258 unq 0 iso 0 dist 6.60405 9.53063 6.6525 7.42673 6.70815 6.47194 15.8417 10.8558 8.09074 9.91199 numMergedOcc 0
42 mol 258 unq 1 iso 0 dist 6.42289 9.53063 5.27959 7.42673 7.99477 6.47194 15.8417 13.2927 8.09074 9.91199 numMergedOcc 0
