0 mol 24 unq 0 iso 0 dist 9.78903 7.70779 6.01284 13.2779 5.05643 9.45579 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 9.95208 9.73278 8.74946 10.6511 3.55124 9.85865 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 9.61144 7.76627 6.98037 6.13521 6.02822 6.9223 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 6.13521 7.76627 6.9223 9.61144 6.02822 6.98037 numMergedOcc 0
4 mol 93 unq 0 iso 0 dist 9.43355 3.74136 7.8435 5.64141 5.21654 5.99269 numMergedOcc 0
5 mol 93 unq 1 iso 0 dist 9.43355 3.74136 7.8435 5.46186 13.3531 5.71763 numMergedOcc 0
6 mol 93 unq 2 iso 0 dist 5.64141 3.74136 5.99269 9.43355 5.21654 7.8435 numMergedOcc 0
7 mol 93 unq 3 iso 0 dist 5.64141 3.74136 5.99269 5.46186 10.7398 5.71763 numMergedOcc 0
8 mol 93 unq 4 iso 0 dist 5.46186 3.74136 5.71763 9.43355 13.3531 7.8435 numMergedOcc 0
9 mol 93 unq 5 iso 0 dist 5.46186 3.74136 5.71763 5.64141 10.7398 5.99269 numMergedOcc 0
10 mol 95 unq 0 iso 0 dist 9.77082 9.2594 7.27506 12.8199 6.12906 8.48088 numMergedOcc 0
11 mol 95 unq 1 iso 0 dist 8.0675 6.85756 7.27506 12.5234 6.12906 8.48088 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 5.44426 11.6279 9.18457 10.877 6.70343 9.14707 numMergedOcc 0
13 mol 98 unq 1 iso 0 dist 8.65429 16.0106 9.14707 13.0419 6.70343 9.18457 numMergedOcc 0
14 mol 112 unq 0 iso 0 dist 5.80831 8.169 5.43933 9.72127 5.20124 9.97483 numMergedOcc 0
15 mol 112 unq 1 iso 0 dist 5.80831 8.169 5.43933 9.77465 6.86881 4.99604 numMergedOcc 0
16 mol 112 unq 2 iso 0 dist 5.80831 8.169 5.43933 13.9633 9.41803 7.44041 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 9.8564 13.8319 5.11043 14.5541 10.5379 8.48313 numMergedOcc 0
18 mol 134 unq 1 iso 0 dist 9.8564 13.8319 5.11043 8.91647 5.83782 6.99345 numMergedOcc 0
19 mol 140 unq 0 iso 0 dist 9.62309 5.85339 7.19291 11.4796 6.09915 6.66504 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 9.22792 7.74227 7.04815 5.00402 6.05141 6.07389 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 5.00402 7.74227 6.07389 9.22792 6.05141 7.04815 numMergedOcc 0
22 mol 225 unq 0 iso 0 dist 7.9002 16.1718 9.57955 12.539 8.05944 8.79277 numMergedOcc 0
23 mol 225 unq 1 iso 0 dist 7.9002 8.96094 9.87668 12.539 8.05944 8.42121 numMergedOcc 0
24 mol 225 unq 2 iso 0 dist 7.9002 8.96094 9.87668 12.6822 16.7885 7.8744 numMergedOcc 0
25 mol 225 unq 3 iso 0 dist 7.9002 8.96094 9.87668 13.4564 13.7858 4.98402 numMergedOcc 0
26 mol 279 unq 0 iso 0 dist 5.35326 4.81143 5.8304 11.2154 11.3734 7.37478 numMergedOcc 0
27 mol 292 unq 0 iso 0 dist 9.13412 6.13368 9.2558 10.5082 3.57128 9.84946 numMergedOcc 0
